1-[4-(3,4-dimethylphenyl)piperazin-1-yl]-3-(diphenylamino)propan-1-one hydrochloride

Systemtic Name: 1-[4-(3,4-dimethylphenyl)piperazin-1-yl]-3-(diphenylamino)propan-1-one hydrochloride Openeye Name: 1-[4-(3,4-dimethylphenyl)piperazin-1-yl]-3-(N-phenylanilino)propan-1-one hydrochloride CAS Name: 1-[4-(3,4-dimethylphenyl)-1-piperazinyl]-3-(N-phenylanilino)-1-propanone hydrochloride IUPAC Name: 1-[4-(3,4-dimethylphenyl)piperazin-1-yl]-3-(N-phenylanilino)propan-1-one hydrochloride Traditional Name: 1-[4-(3,4-dimethylphenyl)piperazino]-3-(N-phenylanilino)propan-1-one hydrochloride Formula: C27H32ClN3O MolecularWeight: 450.01548

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H31N3O.ClH/c1-22-13-14-26(21-23(22)2)28-17-19-29(20-18-28)27(31)15-16-30(24-9-5-3-6-10-24)25-11-7-4-8-12-25;/h3-14,21H,15-20H2,1-2H3;1H