3-[4-(4-ethanoylphenyl)piperazin-1-yl]-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[4-(4-ethanoylphenyl)piperazin-1-yl]-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione Openeye Name: 3-[4-(4-acetylphenyl)piperazin-1-yl]-4-(p-tolyl)cyclobut-3-ene-1,2-dione CAS Name: 3-[4-(4-acetylphenyl)-1-piperazinyl]-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione IUPAC Name: 3-[4-(4-acetylphenyl)piperazin-1-yl]-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione Traditional Name: 3-[4-(4-acetylphenyl)piperazino]-4-(p-tolyl)cyclobut-3-ene-1,2-quinone Formula: C23H22N2O3 MolecularWeight: 374.43238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=O)C2=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=O)C2=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C

InChI

InChI=1S/C23H22N2O3/c1-15-3-5-18(6-4-15)20-21(23(28)22(20)27)25-13-11-24(12-14-25)19-9-7-17(8-10-19)16(2)26/h3-10H,11-14H2,1-2H3