1-(2-methoxy-5-methyl-phenyl)-4-[4-(2-methylphenyl)piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(2-methoxy-5-methyl-phenyl)-4-[4-(2-methylphenyl)piperazin-1-yl]butane-1,4-dione Openeye Name: 1-(2-methoxy-5-methyl-phenyl)-4-[4-(o-tolyl)piperazin-1-yl]butane-1,4-dione CAS Name: 1-(2-methoxy-5-methylphenyl)-4-[4-(2-methylphenyl)-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(2-methoxy-5-methylphenyl)-4-[4-(2-methylphenyl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(2-methoxy-5-methyl-phenyl)-4-[4-(o-tolyl)piperazino]butane-1,4-dione Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(=O)CCC(=O)N2CCN(CC2)C3=CC=CC=C3C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(=O)CCC(=O)N2CCN(CC2)C3=CC=CC=C3C

InChI

InChI=1S/C23H28N2O3/c1-17-8-10-22(28-3)19(16-17)21(26)9-11-23(27)25-14-12-24(13-15-25)20-7-5-4-6-18(20)2/h4-8,10,16H,9,11-15H2,1-3H3