1-(3,4-dimethylphenyl)-4-[4-(phenylcarbonyl)piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(3,4-dimethylphenyl)-4-[4-(phenylcarbonyl)piperazin-1-yl]butane-1,4-dione Openeye Name: 1-(4-benzoylpiperazin-1-yl)-4-(3,4-dimethylphenyl)butane-1,4-dione CAS Name: 1-(4-benzoyl-1-piperazinyl)-4-(3,4-dimethylphenyl)butane-1,4-dione IUPAC Name: 1-(4-benzoylpiperazin-1-yl)-4-(3,4-dimethylphenyl)butane-1,4-dione Traditional Name: 1-(4-benzoylpiperazino)-4-(3,4-dimethylphenyl)butane-1,4-dione Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)CCC(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)CCC(=O)N2CCN(CC2)C(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C23H26N2O3/c1-17-8-9-20(16-18(17)2)21(26)10-11-22(27)24-12-14-25(15-13-24)23(28)19-6-4-3-5-7-19/h3-9,16H,10-15H2,1-2H3