335896 <common-name>[4-(dimethylamino)-2-naphthalen-1-ylbutyl] benzoate</common-name> <description>[4-(dimethylamino)-2-naphthalen-1-ylbutyl] benzoate is a chemical compound with the formula C23H25NO2. It has an average molecular weight of 347.40 g/mol.</description> <cas nil="true"/> <pubchem-id>3088870</pubchem-id> <chemical-formula>C23H25NO2</chemical-formula> <weight>347.4</weight> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2026-08-30T18:09:41Z</created-at> <updated-at type="dateTime">2026-08-30T18:09:41Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id nil="true"/> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>CN(C)CCC(COC(=O)C1=CC=CC=C1)C2=CC=CC3=CC=CC=C32</moldb-smiles> <moldb-formula>C23H25NO2</moldb-formula> <moldb-inchi>InChI=1S/C23H25NO2/c1-24(2)16-15-20(17-26-23(25)19-10-4-3-5-11-19)22-14-8-12-18-9-6-7-13-21(18)22/h3-14,20H,15-17H2,1-2H3</moldb-inchi> <moldb-inchikey>GNYYDHPDLMXQFV-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">347.188529</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>5.2</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id nil="true"/> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM331789</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id nil="true"/> <iupac>[4-(dimethylamino)-2-naphthalen-1-ylbutyl] benzoate</iupac> <moldb-polar-surface-area nil="true"/> <moldb-refractivity nil="true"/> <moldb-polarizability nil="true"/> <moldb-rotatable-bond-count nil="true"/> <moldb-acceptor-count nil="true"/> <moldb-donor-count nil="true"/> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge nil="true"/> <moldb-number-of-rings nil="true"/> <moldb-alogps-logp nil="true"/> <moldb-alogps-logs nil="true"/> <moldb-alogps-solubility nil="true"/> <kingdom>Organic compounds</kingdom> <superklass>Benzenoids</superklass> <klass>Naphthalenes</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0286362</sync-id> <structure-inchikey>GNYYDHPDLMXQFV-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000800800000000200000050000000000000000000000400000000000000000000000000000000000004000000000000000000000000000000000040000000000044000002000000000028000000000500000000001000000000000000010000000000000000004000000000000000000000000000000000000001000040000001800080000080000000100000000100000000000000000000000000000000000000040000084000000000001000000000000000000000200000000000040000000000000000000000000000004000000000000300000000000000000000000001000040000000000400000001000000004200000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAaAAAAHAAAAIABBgBgAAAAAQMHACAAAAAD BgBgAAAAAQMGAGAAAAACAgYAYAAAAAICBgBgAAAAAwEGAGAAAAACAggAKAAA AAMCBgAoAAAAAwQIACgAAAADAgZAKAAAAAMEBkBoAAAAAwMBBkBoAAAAAwMB BkBoAAAAAwMBBkBoAAAAAwMBBkBoAAAAAwMBBkAoAAAAAwQGQGgAAAADAwEG QGgAAAADAwEGQGgAAAADAwEGQCgAAAADBAZAaAAAAAMDAQZAaAAAAAMDAQZA aAAAAAMDAQZAaAAAAAMDAQZAKAAAAAMECwABAAECAAEDAAMEAAQFAAUGAAYH AAcIIAgJKAIICiAKC2gMCwxoDAwNaAwNDmgMDg9oDAUQABARaAwREmgMEhNo DBMUaAwUFWgMFRZoDBYXaAwXGGgMGBloDA8KaAwZEGgMGRRoDEIDAAAABgsM DQ4PCgYREhMUGRAGFRYXGBkUFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:37:30Z</structure-indexed-at> </compound>