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

Systemtic Name: 2-(4-methoxy-2-nitro-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: 2-(4-methoxy-2-nitro-phenyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(4-methoxy-2-nitrophenyl)-1,3-dioxo-5-isoindolecarboxylate IUPAC Name: 2-(4-methoxy-2-nitrophenyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(4-methoxy-2-nitro-phenyl)isoindoline-5-carboxylate Formula: C16H9N2O7- MolecularWeight: 341.25186

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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)/p-1