[3-methyl-2-[(1E,3E)-4-phenylbuta-1,3-dienyl]piperidin-4-yl] 2-methylpropanoate hydrochloride

Systemtic Name: [3-methyl-2-[(1E,3E)-4-phenylbuta-1,3-dienyl]piperidin-4-yl] 2-methylpropanoate hydrochloride Openeye Name: [3-methyl-2-[(1E,3E)-4-phenylbuta-1,3-dienyl]-4-piperidyl] 2-methylpropanoate hydrochloride CAS Name: 2-methylpropanoic acid [3-methyl-2-[(1E,3E)-4-phenylbuta-1,3-dienyl]-4-piperidinyl] ester hydrochloride IUPAC Name: [3-methyl-2-[(1E,3E)-4-phenylbuta-1,3-dienyl]piperidin-4-yl] 2-methylpropanoate hydrochloride Traditional Name: 2-methylpropionic acid [3-methyl-2-[(1E,3E)-4-phenylbuta-1,3-dienyl]-4-piperidyl] ester hydrochloride Formula: C20H28ClNO2 MolecularWeight: 349.89482

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CCNC1C=CC=CC2=CC=CC=C2)OC(=O)C(C)C.Cl

Isomeric SMILES

CC1C(CCNC1/C=C/C=C/C2=CC=CC=C2)OC(=O)C(C)C.Cl

InChI

InChI=1S/C20H27NO2.ClH/c1-15(2)20(22)23-19-13-14-21-18(16(19)3)12-8-7-11-17-9-5-4-6-10-17;/h4-12,15-16,18-19,21H,13-14H2,1-3H3;1H/b11-7+,12-8+;