(2S)-2-(4-chlorophenyl)-1-[4-(4-ethanoylphenyl)piperazin-1-yl]-3-methyl-butan-1-one

Systemtic Name: (2S)-2-(4-chlorophenyl)-1-[4-(4-ethanoylphenyl)piperazin-1-yl]-3-methyl-butan-1-one Openeye Name: (2S)-1-[4-(4-acetylphenyl)piperazin-1-yl]-2-(4-chlorophenyl)-3-methyl-butan-1-one CAS Name: (2S)-1-[4-(4-acetylphenyl)-1-piperazinyl]-2-(4-chlorophenyl)-3-methyl-1-butanone IUPAC Name: (2S)-1-[4-(4-acetylphenyl)piperazin-1-yl]-2-(4-chlorophenyl)-3-methylbutan-1-one Traditional Name: (2S)-1-[4-(4-acetylphenyl)piperazino]-2-(4-chlorophenyl)-3-methyl-butan-1-one Formula: C23H27ClN2O2 MolecularWeight: 398.92568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)Cl)C(=O)N2CCN(CC2)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC(C)[C@@H](C1=CC=C(C=C1)Cl)C(=O)N2CCN(CC2)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C23H27ClN2O2/c1-16(2)22(19-4-8-20(24)9-5-19)23(28)26-14-12-25(13-15-26)21-10-6-18(7-11-21)17(3)27/h4-11,16,22H,12-15H2,1-3H3/t22-/m0/s1