[2-(dimethylaminomethyl)-1-propyl-cyclohexyl] 2,2-diphenylethanoate hydrochloride

Systemtic Name: [2-(dimethylaminomethyl)-1-propyl-cyclohexyl] 2,2-diphenylethanoate hydrochloride Openeye Name: [2-(dimethylaminomethyl)-1-propyl-cyclohexyl] 2,2-diphenylacetate hydrochloride CAS Name: 2,2-diphenylacetic acid [2-(dimethylaminomethyl)-1-propylcyclohexyl] ester hydrochloride IUPAC Name: [2-(dimethylaminomethyl)-1-propylcyclohexyl] 2,2-diphenylacetate hydrochloride Traditional Name: 2,2-diphenylacetic acid [2-(dimethylaminomethyl)-1-propyl-cyclohexyl] ester hydrochloride Formula: C26H36ClNO2 MolecularWeight: 430.02254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCCCC1CN(C)C)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3.Cl

Isomeric SMILES

CCCC1(CCCCC1CN(C)C)OC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3.Cl

InChI

InChI=1S/C26H35NO2.ClH/c1-4-18-26(19-12-11-17-23(26)20-27(2)3)29-25(28)24(21-13-7-5-8-14-21)22-15-9-6-10-16-22;/h5-10,13-16,23-24H,4,11-12,17-20H2,1-3H3;1H