2-[(4-nitrophenyl)amino]-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: 2-[(4-nitrophenyl)amino]-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: 2-(4-nitroanilino)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(4-nitroanilino)-1,3-dioxo-5-isoindolecarboxylate IUPAC Name: 2-(4-nitroanilino)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(4-nitroanilino)isoindoline-5-carboxylate Formula: C15H8N3O6- MolecularWeight: 326.24052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H9N3O6/c19-13-11-6-1-8(15(21)22)7-12(11)14(20)17(13)16-9-2-4-10(5-3-9)18(23)24/h1-7,16H,(H,21,22)/p-1