5-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-2-(5-methyl-1,2-oxazol-3-yl)isoindole-1,3-dione

Systemtic Name: 5-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-2-(5-methyl-1,2-oxazol-3-yl)isoindole-1,3-dione Openeye Name: 5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-2-(5-methylisoxazol-3-yl)isoindoline-1,3-dione CAS Name: 5-[[4-(2,3-dimethylphenyl)-1-piperazinyl]-oxomethyl]-2-(5-methyl-3-isoxazolyl)isoindole-1,3-dione IUPAC Name: 5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-2-(5-methyl-1,2-oxazol-3-yl)isoindole-1,3-dione Traditional Name: 5-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-2-(5-methylisoxazol-3-yl)isoindoline-1,3-quinone Formula: C25H24N4O4 MolecularWeight: 444.48246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)C5=NOC(=C5)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)C5=NOC(=C5)C)C

InChI

InChI=1S/C25H24N4O4/c1-15-5-4-6-21(17(15)3)27-9-11-28(12-10-27)23(30)18-7-8-19-20(14-18)25(32)29(24(19)31)22-13-16(2)33-26-22/h4-8,13-14H,9-12H2,1-3H3