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

Systemtic Name: 3-(3,4-dimethylphenyl)-4-[4-(4-ethanoylphenyl)piperazin-1-yl]cyclobut-3-ene-1,2-dione Openeye Name: 3-[4-(4-acetylphenyl)piperazin-1-yl]-4-(3,4-dimethylphenyl)cyclobut-3-ene-1,2-dione CAS Name: 3-[4-(4-acetylphenyl)-1-piperazinyl]-4-(3,4-dimethylphenyl)cyclobut-3-ene-1,2-dione IUPAC Name: 3-[4-(4-acetylphenyl)piperazin-1-yl]-4-(3,4-dimethylphenyl)cyclobut-3-ene-1,2-dione Traditional Name: 3-[4-(4-acetylphenyl)piperazino]-4-(3,4-dimethylphenyl)cyclobut-3-ene-1,2-quinone Formula: C24H24N2O3 MolecularWeight: 388.45896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H24N2O3/c1-15-4-5-19(14-16(15)2)21-22(24(29)23(21)28)26-12-10-25(11-13-26)20-8-6-18(7-9-20)17(3)27/h4-9,14H,10-13H2,1-3H3