(3S,4S)-3-butyl-1-(4-methoxy-3-phenyl-phenyl)piperidin-4-amine hydrochloride

Systemtic Name: (3S,4S)-3-butyl-1-(4-methoxy-3-phenyl-phenyl)piperidin-4-amine hydrochloride Openeye Name: (3S,4S)-3-butyl-1-(4-methoxy-3-phenyl-phenyl)piperidin-4-amine hydrochloride CAS Name: (3S,4S)-3-butyl-1-(4-methoxy-3-phenylphenyl)-4-piperidinamine hydrochloride IUPAC Name: (3S,4S)-3-butyl-1-(4-methoxy-3-phenylphenyl)piperidin-4-amine hydrochloride Traditional Name: [(3S,4S)-3-butyl-1-(4-methoxy-3-phenyl-phenyl)-4-piperidyl]amine hydrochloride Formula: C22H31ClN2O MolecularWeight: 374.94734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CCC1N)C2=CC(=C(C=C2)OC)C3=CC=CC=C3.Cl

Isomeric SMILES

CCCC[C@H]1CN(CC[C@@H]1N)C2=CC(=C(C=C2)OC)C3=CC=CC=C3.Cl

InChI

InChI=1S/C22H30N2O.ClH/c1-3-4-8-18-16-24(14-13-21(18)23)19-11-12-22(25-2)20(15-19)17-9-6-5-7-10-17;/h5-7,9-12,15,18,21H,3-4,8,13-14,16,23H2,1-2H3;1H/t18-,21-;/m0./s1