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

Systemtic Name: 2-[(4-nitrophenyl)carbonylamino]-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: 2-[(4-nitrobenzoyl)amino]-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-[[(4-nitrophenyl)-oxomethyl]amino]-1,3-dioxo-5-isoindolecarboxylate IUPAC Name: 2-[(4-nitrobenzoyl)amino]-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-[(4-nitrobenzoyl)amino]isoindoline-5-carboxylate Formula: C16H8N3O7- MolecularWeight: 354.25062

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H9N3O7/c20-13(8-1-4-10(5-2-8)19(25)26)17-18-14(21)11-6-3-9(16(23)24)7-12(11)15(18)22/h1-7H,(H,17,20)(H,23,24)/p-1