2-(2,4-dimethylphenyl)-N-(5-nitro-2-oxidanyl-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-(2,4-dimethylphenyl)-N-(5-nitro-2-oxidanyl-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-(2,4-dimethylphenyl)-N-(2-hydroxy-5-nitro-phenyl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-(2,4-dimethylphenyl)-N-(2-hydroxy-5-nitrophenyl)-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-(2,4-dimethylphenyl)-N-(2-hydroxy-5-nitrophenyl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-(2,4-dimethylphenyl)-N-(2-hydroxy-5-nitro-phenyl)-1,3-diketo-isoindoline-5-carboxamide Formula: C23H17N3O6 MolecularWeight: 431.39758

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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)NC4=C(C=CC(=C4)[N+](=O)[O-])O)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])O)C

InChI

InChI=1S/C23H17N3O6/c1-12-3-7-19(13(2)9-12)25-22(29)16-6-4-14(10-17(16)23(25)30)21(28)24-18-11-15(26(31)32)5-8-20(18)27/h3-11,27H,1-2H3,(H,24,28)