2-[[5-[4-[(2,4-dimethylphenyl)amino]phthalazin-1-yl]-2-methyl-phenyl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[5-[4-[(2,4-dimethylphenyl)amino]phthalazin-1-yl]-2-methyl-phenyl]methyl]isoindole-1,3-dione Openeye Name: 2-[[5-[4-(2,4-dimethylanilino)phthalazin-1-yl]-2-methyl-phenyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[5-[4-(2,4-dimethylanilino)-1-phthalazinyl]-2-methylphenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[5-[4-(2,4-dimethylanilino)phthalazin-1-yl]-2-methylphenyl]methyl]isoindole-1,3-dione Traditional Name: 2-[5-[4-(2,4-dimethylanilino)phthalazin-1-yl]-2-methyl-benzyl]isoindoline-1,3-quinone Formula: C32H26N4O2 MolecularWeight: 498.57444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC(=C(C=C4)C)CN5C(=O)C6=CC=CC=C6C5=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=NN=C(C3=CC=CC=C32)C4=CC(=C(C=C4)C)CN5C(=O)C6=CC=CC=C6C5=O)C

InChI

InChI=1S/C32H26N4O2/c1-19-12-15-28(21(3)16-19)33-30-25-9-5-4-8-24(25)29(34-35-30)22-14-13-20(2)23(17-22)18-36-31(37)26-10-6-7-11-27(26)32(36)38/h4-17H,18H2,1-3H3,(H,33,35)