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

Systemtic Name: 1-(4-tert-butylphenyl)-4-[4-(cyclohexyl-oxidanyl-phenyl-methyl)piperidin-1-yl]butan-1-one hydrochloride Openeye Name: 1-(4-tert-butylphenyl)-4-[4-(cyclohexyl-hydroxy-phenyl-methyl)-1-piperidyl]butan-1-one hydrochloride CAS Name: 1-(4-tert-butylphenyl)-4-[4-(cyclohexyl-hydroxy-phenylmethyl)-1-piperidinyl]-1-butanone hydrochloride IUPAC Name: 1-(4-tert-butylphenyl)-4-[4-(cyclohexyl-hydroxy-phenylmethyl)piperidin-1-yl]butan-1-one hydrochloride Traditional Name: 1-(4-tert-butylphenyl)-4-[4-(cyclohexyl-hydroxy-phenyl-methyl)piperidino]butan-1-one hydrochloride Formula: C32H46ClNO2 MolecularWeight: 512.16614

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)CCCN2CCC(CC2)C(C3CCCCC3)(C4=CC=CC=C4)O.Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)CCCN2CCC(CC2)C(C3CCCCC3)(C4=CC=CC=C4)O.Cl

InChI

InChI=1S/C32H45NO2.ClH/c1-31(2,3)26-18-16-25(17-19-26)30(34)15-10-22-33-23-20-29(21-24-33)32(35,27-11-6-4-7-12-27)28-13-8-5-9-14-28;/h4,6-7,11-12,16-19,28-29,35H,5,8-10,13-15,20-24H2,1-3H3;1H