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

Systemtic Name: 1-(4-tert-butylphenyl)-4-[4-[(4-tert-butylphenyl)-oxidanyl-phenyl-methyl]piperidin-1-yl]butan-1-one hydrochloride Openeye Name: 1-(4-tert-butylphenyl)-4-[4-[(4-tert-butylphenyl)-hydroxy-phenyl-methyl]-1-piperidyl]butan-1-one hydrochloride CAS Name: 1-(4-tert-butylphenyl)-4-[4-[(4-tert-butylphenyl)-hydroxy-phenylmethyl]-1-piperidinyl]-1-butanone hydrochloride IUPAC Name: 1-(4-tert-butylphenyl)-4-[4-[(4-tert-butylphenyl)-hydroxy-phenylmethyl]piperidin-1-yl]butan-1-one hydrochloride Traditional Name: 1-(4-tert-butylphenyl)-4-[4-[(4-tert-butylphenyl)-hydroxy-phenyl-methyl]piperidino]butan-1-one hydrochloride Formula: C36H48ClNO2 MolecularWeight: 562.22482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C36H47NO2.ClH/c1-34(2,3)28-16-14-27(15-17-28)33(38)13-10-24-37-25-22-32(23-26-37)36(39,30-11-8-7-9-12-30)31-20-18-29(19-21-31)35(4,5)6;/h7-9,11-12,14-21,32,39H,10,13,22-26H2,1-6H3;1H