2-[2-[2-(3,5-dimethylphenyl)-5-oxidanyl-1H-indol-3-yl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[2-(3,5-dimethylphenyl)-5-oxidanyl-1H-indol-3-yl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[2-(3,5-dimethylphenyl)-5-hydroxy-1H-indol-3-yl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[2-(3,5-dimethylphenyl)-5-hydroxy-1H-indol-3-yl]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[2-(3,5-dimethylphenyl)-5-hydroxy-1H-indol-3-yl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[2-(3,5-dimethylphenyl)-5-hydroxy-1H-indol-3-yl]ethyl]isoindoline-1,3-quinone Formula: C26H22N2O3 MolecularWeight: 410.46448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)O)CCN4C(=O)C5=CC=CC=C5C4=O)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)O)CCN4C(=O)C5=CC=CC=C5C4=O)C

InChI

InChI=1S/C26H22N2O3/c1-15-11-16(2)13-17(12-15)24-19(22-14-18(29)7-8-23(22)27-24)9-10-28-25(30)20-5-3-4-6-21(20)26(28)31/h3-8,11-14,27,29H,9-10H2,1-2H3