2-[5-methyl-4-(4-propan-2-ylphenyl)pyridazino[4,3-b]indol-3-yl]isoindole-1,3-dione

Systemtic Name: 2-[5-methyl-4-(4-propan-2-ylphenyl)pyridazino[4,3-b]indol-3-yl]isoindole-1,3-dione Openeye Name: 2-[4-(4-isopropylphenyl)-5-methyl-pyridazino[4,3-b]indol-3-yl]isoindoline-1,3-dione CAS Name: 2-[5-methyl-4-(4-propan-2-ylphenyl)-3-pyridazino[4,3-b]indolyl]isoindole-1,3-dione IUPAC Name: 2-[5-methyl-4-(4-propan-2-ylphenyl)pyridazino[4,3-b]indol-3-yl]isoindole-1,3-dione Traditional Name: 2-(5-methyl-4-p-cumenyl-pyridazin[4,3-b]indol-3-yl)isoindoline-1,3-quinone Formula: C28H22N4O2 MolecularWeight: 446.49988

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=C3C(=NN=C2N4C(=O)C5=CC=CC=C5C4=O)C6=CC=CC=C6N3C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=C3C(=NN=C2N4C(=O)C5=CC=CC=C5C4=O)C6=CC=CC=C6N3C

InChI

InChI=1S/C28H22N4O2/c1-16(2)17-12-14-18(15-13-17)23-25-24(21-10-6-7-11-22(21)31(25)3)29-30-26(23)32-27(33)19-8-4-5-9-20(19)28(32)34/h4-16H,1-3H3