5-(6,7-dimethoxy-4-oxidanylidene-3,1-benzoxazin-2-yl)-2-(2,4-dimethylphenyl)isoindole-1,3-dione

Systemtic Name: 5-(6,7-dimethoxy-4-oxidanylidene-3,1-benzoxazin-2-yl)-2-(2,4-dimethylphenyl)isoindole-1,3-dione Openeye Name: 5-(6,7-dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(2,4-dimethylphenyl)isoindoline-1,3-dione CAS Name: 5-(6,7-dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(2,4-dimethylphenyl)isoindole-1,3-dione IUPAC Name: 5-(6,7-dimethoxy-4-oxo-3,1-benzoxazin-2-yl)-2-(2,4-dimethylphenyl)isoindole-1,3-dione Traditional Name: 2-(2,4-dimethylphenyl)-5-(4-keto-6,7-dimethoxy-3,1-benzoxazin-2-yl)isoindoline-1,3-quinone Formula: C26H20N2O6 MolecularWeight: 456.4468

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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)C4=NC5=CC(=C(C=C5C(=O)O4)OC)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=CC(=C(C=C5C(=O)O4)OC)OC)C

InChI

InChI=1S/C26H20N2O6/c1-13-5-8-20(14(2)9-13)28-24(29)16-7-6-15(10-17(16)25(28)30)23-27-19-12-22(33-4)21(32-3)11-18(19)26(31)34-23/h5-12H,1-4H3