2-(4-methylphenyl)-5-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]carbonyl-isoindole-1,3-dione

Systemtic Name: 2-(4-methylphenyl)-5-[4-(2,4,6-trimethylphenyl)piperazin-1-yl]carbonyl-isoindole-1,3-dione Openeye Name: 2-(p-tolyl)-5-[4-(2,4,6-trimethylphenyl)piperazine-1-carbonyl]isoindoline-1,3-dione CAS Name: 2-(4-methylphenyl)-5-[oxo-[4-(2,4,6-trimethylphenyl)-1-piperazinyl]methyl]isoindole-1,3-dione IUPAC Name: 2-(4-methylphenyl)-5-[4-(2,4,6-trimethylphenyl)piperazine-1-carbonyl]isoindole-1,3-dione Traditional Name: 5-(4-mesitylpiperazine-1-carbonyl)-2-(p-tolyl)isoindoline-1,3-quinone Formula: C29H29N3O3 MolecularWeight: 467.55886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)C5=C(C=C(C=C5C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)C5=C(C=C(C=C5C)C)C

InChI

InChI=1S/C29H29N3O3/c1-18-5-8-23(9-6-18)32-28(34)24-10-7-22(17-25(24)29(32)35)27(33)31-13-11-30(12-14-31)26-20(3)15-19(2)16-21(26)4/h5-10,15-17H,11-14H2,1-4H3