2-(4-methoxy-2-nitro-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid

Systemtic Name: 2-(4-methoxy-2-nitro-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid Openeye Name: 2-(4-methoxy-2-nitro-phenyl)-1,3-dioxo-isoindoline-5-carboxylic acid CAS Name: 2-(4-methoxy-2-nitrophenyl)-1,3-dioxo-5-isoindolecarboxylic acid IUPAC Name: 2-(4-methoxy-2-nitrophenyl)-1,3-dioxoisoindole-5-carboxylic acid Traditional Name: 1,3-diketo-2-(4-methoxy-2-nitro-phenyl)isoindoline-5-carboxylic acid Formula: C16H10N2O7 MolecularWeight: 342.2598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C16H10N2O7/c1-25-9-3-5-12(13(7-9)18(23)24)17-14(19)10-4-2-8(16(21)22)6-11(10)15(17)20/h2-7H,1H3,(H,21,22)