1-[4-(2,2-dimethylpropyl)phenyl]-4-[4-(diphenylmethylidene)piperidin-1-yl]butan-1-one

Systemtic Name: 1-[4-(2,2-dimethylpropyl)phenyl]-4-[4-(diphenylmethylidene)piperidin-1-yl]butan-1-one Openeye Name: 4-(4-benzhydrylidene-1-piperidyl)-1-[4-(2,2-dimethylpropyl)phenyl]butan-1-one CAS Name: 1-[4-(2,2-dimethylpropyl)phenyl]-4-[4-(diphenylmethylene)-1-piperidinyl]-1-butanone IUPAC Name: 4-(4-benzhydrylidenepiperidin-1-yl)-1-[4-(2,2-dimethylpropyl)phenyl]butan-1-one Traditional Name: 4-(4-benzhydrylidenepiperidino)-1-(4-neopentylphenyl)butan-1-one Formula: C33H39NO MolecularWeight: 465.66886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=CC=C(C=C1)C(=O)CCCN2CCC(=C(C3=CC=CC=C3)C4=CC=CC=C4)CC2

Isomeric SMILES

CC(C)(C)CC1=CC=C(C=C1)C(=O)CCCN2CCC(=C(C3=CC=CC=C3)C4=CC=CC=C4)CC2

InChI

InChI=1S/C33H39NO/c1-33(2,3)25-26-16-18-27(19-17-26)31(35)15-10-22-34-23-20-30(21-24-34)32(28-11-6-4-7-12-28)29-13-8-5-9-14-29/h4-9,11-14,16-19H,10,15,20-25H2,1-3H3