1-(4-tert-butylphenyl)-4-[4-[(4-tert-butylphenyl)-phenyl-methylidene]piperidin-1-yl]butan-1-one hydrochloride

Systemtic Name: 1-(4-tert-butylphenyl)-4-[4-[(4-tert-butylphenyl)-phenyl-methylidene]piperidin-1-yl]butan-1-one hydrochloride Openeye Name: 1-(4-tert-butylphenyl)-4-[4-[(4-tert-butylphenyl)-phenyl-methylene]-1-piperidyl]butan-1-one hydrochloride CAS Name: 1-(4-tert-butylphenyl)-4-[4-[(4-tert-butylphenyl)-phenylmethylidene]-1-piperidinyl]-1-butanone hydrochloride IUPAC Name: 1-(4-tert-butylphenyl)-4-[4-[(4-tert-butylphenyl)-phenylmethylidene]piperidin-1-yl]butan-1-one hydrochloride Traditional Name: 1-(4-tert-butylphenyl)-4-[4-[(4-tert-butylphenyl)-phenyl-methylene]piperidino]butan-1-one hydrochloride Formula: C36H46ClNO MolecularWeight: 544.20954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CCCN2CCC(=C(C3=CC=CC=C3)C4=CC=C(C=C4)C(C)(C)C)CC2.Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CCCN2CCC(=C(C3=CC=CC=C3)C4=CC=C(C=C4)C(C)(C)C)CC2.Cl

InChI

InChI=1S/C36H45NO.ClH/c1-35(2,3)31-18-14-27(15-19-31)33(38)13-10-24-37-25-22-30(23-26-37)34(28-11-8-7-9-12-28)29-16-20-32(21-17-29)36(4,5)6;/h7-9,11-12,14-21H,10,13,22-26H2,1-6H3;1H