[1-(3-methoxyphenyl)-2-(piperidin-1-ylmethyl)cyclohexyl] propanoate hydrochloride

Systemtic Name: [1-(3-methoxyphenyl)-2-(piperidin-1-ylmethyl)cyclohexyl] propanoate hydrochloride Openeye Name: [1-(3-methoxyphenyl)-2-(1-piperidylmethyl)cyclohexyl] propanoate hydrochloride CAS Name: propanoic acid [1-(3-methoxyphenyl)-2-(1-piperidinylmethyl)cyclohexyl] ester hydrochloride IUPAC Name: [1-(3-methoxyphenyl)-2-(piperidin-1-ylmethyl)cyclohexyl] propanoate hydrochloride Traditional Name: propionic acid [1-(3-methoxyphenyl)-2-(piperidinomethyl)cyclohexyl] ester hydrochloride Formula: C22H34ClNO3 MolecularWeight: 395.96326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1(CCCCC1CN2CCCCC2)C3=CC(=CC=C3)OC.Cl

Isomeric SMILES

CCC(=O)OC1(CCCCC1CN2CCCCC2)C3=CC(=CC=C3)OC.Cl

InChI

InChI=1S/C22H33NO3.ClH/c1-3-21(24)26-22(18-11-9-12-20(16-18)25-2)13-6-5-10-19(22)17-23-14-7-4-8-15-23;/h9,11-12,16,19H,3-8,10,13-15,17H2,1-2H3;1H