(E)-4,4-dimethyl-1-(4-methylphenyl)-5-piperidin-1-yl-pent-1-en-3-one hydrochloride

Systemtic Name: (E)-4,4-dimethyl-1-(4-methylphenyl)-5-piperidin-1-yl-pent-1-en-3-one hydrochloride Openeye Name: (E)-4,4-dimethyl-5-(1-piperidyl)-1-(p-tolyl)pent-1-en-3-one hydrochloride CAS Name: (E)-4,4-dimethyl-1-(4-methylphenyl)-5-(1-piperidinyl)-1-penten-3-one hydrochloride IUPAC Name: (E)-4,4-dimethyl-1-(4-methylphenyl)-5-piperidin-1-ylpent-1-en-3-one hydrochloride Traditional Name: (E)-4,4-dimethyl-5-piperidino-1-(p-tolyl)pent-1-en-3-one hydrochloride Formula: C19H28ClNO MolecularWeight: 321.88472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=CC(=O)C(C)(C)CN2CCCCC2.Cl

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/C(=O)C(C)(C)CN2CCCCC2.Cl

InChI

InChI=1S/C19H27NO.ClH/c1-16-7-9-17(10-8-16)11-12-18(21)19(2,3)15-20-13-5-4-6-14-20;/h7-12H,4-6,13-15H2,1-3H3;1H/b12-11+;