[1-cyclohexyl-2-(dimethylaminomethyl)cyclohexyl] (E)-3-phenylprop-2-enoate hydrochloride

Systemtic Name: [1-cyclohexyl-2-(dimethylaminomethyl)cyclohexyl] (E)-3-phenylprop-2-enoate hydrochloride Openeye Name: [1-cyclohexyl-2-(dimethylaminomethyl)cyclohexyl] (E)-3-phenylprop-2-enoate hydrochloride CAS Name: (E)-3-phenyl-2-propenoic acid [1-cyclohexyl-2-(dimethylaminomethyl)cyclohexyl] ester hydrochloride IUPAC Name: [1-cyclohexyl-2-(dimethylaminomethyl)cyclohexyl] (E)-3-phenylprop-2-enoate hydrochloride Traditional Name: (E)-3-phenylacrylic acid [1-cyclohexyl-2-(dimethylaminomethyl)cyclohexyl] ester hydrochloride Formula: C24H36ClNO2 MolecularWeight: 406.00114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CCCCC1(C2CCCCC2)OC(=O)C=CC3=CC=CC=C3.Cl

Isomeric SMILES

CN(C)CC1CCCCC1(C2CCCCC2)OC(=O)/C=C/C3=CC=CC=C3.Cl

InChI

InChI=1S/C24H35NO2.ClH/c1-25(2)19-22-15-9-10-18-24(22,21-13-7-4-8-14-21)27-23(26)17-16-20-11-5-3-6-12-20;/h3,5-6,11-12,16-17,21-22H,4,7-10,13-15,18-19H2,1-2H3;1H/b17-16+;