1-(4-cyclopentylphenyl)-6-[4-(diphenylmethylidene)piperidin-1-yl]hexan-1-one hydrochloride

Systemtic Name: 1-(4-cyclopentylphenyl)-6-[4-(diphenylmethylidene)piperidin-1-yl]hexan-1-one hydrochloride Openeye Name: 6-(4-benzhydrylidene-1-piperidyl)-1-(4-cyclopentylphenyl)hexan-1-one hydrochloride CAS Name: 1-(4-cyclopentylphenyl)-6-[4-(diphenylmethylene)-1-piperidinyl]-1-hexanone hydrochloride IUPAC Name: 6-(4-benzhydrylidenepiperidin-1-yl)-1-(4-cyclopentylphenyl)hexan-1-one hydrochloride Traditional Name: 6-(4-benzhydrylidenepiperidino)-1-(4-cyclopentylphenyl)hexan-1-one hydrochloride Formula: C35H42ClNO MolecularWeight: 528.16708

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C2=CC=C(C=C2)C(=O)CCCCCN3CCC(=C(C4=CC=CC=C4)C5=CC=CC=C5)CC3.Cl

Isomeric SMILES

C1CCC(C1)C2=CC=C(C=C2)C(=O)CCCCCN3CCC(=C(C4=CC=CC=C4)C5=CC=CC=C5)CC3.Cl

InChI

InChI=1S/C35H41NO.ClH/c37-34(30-21-19-29(20-22-30)28-12-9-10-13-28)18-8-3-11-25-36-26-23-33(24-27-36)35(31-14-4-1-5-15-31)32-16-6-2-7-17-32;/h1-2,4-7,14-17,19-22,28H,3,8-13,18,23-27H2;1H