5-[4-(4-methylphenyl)piperazin-1-yl]carbonyl-2-phenyl-isoindole-1,3-dione

Systemtic Name: 5-[4-(4-methylphenyl)piperazin-1-yl]carbonyl-2-phenyl-isoindole-1,3-dione Openeye Name: 2-phenyl-5-[4-(p-tolyl)piperazine-1-carbonyl]isoindoline-1,3-dione CAS Name: 5-[[4-(4-methylphenyl)-1-piperazinyl]-oxomethyl]-2-phenylisoindole-1,3-dione IUPAC Name: 5-[4-(4-methylphenyl)piperazine-1-carbonyl]-2-phenylisoindole-1,3-dione Traditional Name: 2-phenyl-5-[4-(p-tolyl)piperazine-1-carbonyl]isoindoline-1,3-quinone Formula: C26H23N3O3 MolecularWeight: 425.47912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23N3O3/c1-18-7-10-20(11-8-18)27-13-15-28(16-14-27)24(30)19-9-12-22-23(17-19)26(32)29(25(22)31)21-5-3-2-4-6-21/h2-12,17H,13-16H2,1H3