[1-butyl-2-(dimethylaminomethyl)cyclohexyl] benzoate hydrochloride

Systemtic Name: [1-butyl-2-(dimethylaminomethyl)cyclohexyl] benzoate hydrochloride Openeye Name: [1-butyl-2-(dimethylaminomethyl)cyclohexyl] benzoate hydrochloride CAS Name: benzoic acid [1-butyl-2-(dimethylaminomethyl)cyclohexyl] ester hydrochloride IUPAC Name: [1-butyl-2-(dimethylaminomethyl)cyclohexyl] benzoate hydrochloride Traditional Name: benzoic acid [1-butyl-2-(dimethylaminomethyl)cyclohexyl] ester hydrochloride Formula: C20H32ClNO2 MolecularWeight: 353.92658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CCCCC1CN(C)C)OC(=O)C2=CC=CC=C2.Cl

Isomeric SMILES

CCCCC1(CCCCC1CN(C)C)OC(=O)C2=CC=CC=C2.Cl

InChI

InChI=1S/C20H31NO2.ClH/c1-4-5-14-20(15-10-9-13-18(20)16-21(2)3)23-19(22)17-11-7-6-8-12-17;/h6-8,11-12,18H,4-5,9-10,13-16H2,1-3H3;1H