2-(2,5-dimethylphenoxy)-1-[4-(diphenylmethyl)piperazin-1-yl]ethanone hydrochloride

Systemtic Name: 2-(2,5-dimethylphenoxy)-1-[4-(diphenylmethyl)piperazin-1-yl]ethanone hydrochloride Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-2-(2,5-dimethylphenoxy)ethanone hydrochloride CAS Name: 2-(2,5-dimethylphenoxy)-1-[4-(diphenylmethyl)-1-piperazinyl]ethanone hydrochloride IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-2-(2,5-dimethylphenoxy)ethanone hydrochloride Traditional Name: 1-(4-benzhydrylpiperazino)-2-(2,5-dimethylphenoxy)ethanone hydrochloride Formula: C27H31ClN2O2 MolecularWeight: 451.00024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4.Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4.Cl

InChI

InChI=1S/C27H30N2O2.ClH/c1-21-13-14-22(2)25(19-21)31-20-26(30)28-15-17-29(18-16-28)27(23-9-5-3-6-10-23)24-11-7-4-8-12-24;/h3-14,19,27H,15-18,20H2,1-2H3;1H