1-[3,4-bis(phenylmethoxy)phenyl]-2-(1-phenylethylamino)butan-1-one hydrochloride

Systemtic Name: 1-[3,4-bis(phenylmethoxy)phenyl]-2-(1-phenylethylamino)butan-1-one hydrochloride Openeye Name: 1-(3,4-dibenzyloxyphenyl)-2-(1-phenylethylamino)butan-1-one hydrochloride CAS Name: 1-[3,4-bis(phenylmethoxy)phenyl]-2-(1-phenylethylamino)-1-butanone hydrochloride IUPAC Name: 1-[3,4-bis(phenylmethoxy)phenyl]-2-(1-phenylethylamino)butan-1-one hydrochloride Traditional Name: 1-(3,4-dibenzoxyphenyl)-2-(1-phenylethylamino)butan-1-one hydrochloride Formula: C32H34ClNO3 MolecularWeight: 516.07026

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC(=C(C=C1)OCC2=CC=CC=C2)OCC3=CC=CC=C3)NC(C)C4=CC=CC=C4.Cl

Isomeric SMILES

CCC(C(=O)C1=CC(=C(C=C1)OCC2=CC=CC=C2)OCC3=CC=CC=C3)NC(C)C4=CC=CC=C4.Cl

InChI

InChI=1S/C32H33NO3.ClH/c1-3-29(33-24(2)27-17-11-6-12-18-27)32(34)28-19-20-30(35-22-25-13-7-4-8-14-25)31(21-28)36-23-26-15-9-5-10-16-26;/h4-21,24,29,33H,3,22-23H2,1-2H3;1H