methyl 5-(4-nitrophenyl)-4,6-bis(oxidanylidene)-2H-pyrrolo[3,4-c]pyrazole-3-carboxylate

Systemtic Name: methyl 5-(4-nitrophenyl)-4,6-bis(oxidanylidene)-2H-pyrrolo[3,4-c]pyrazole-3-carboxylate Openeye Name: methyl 5-(4-nitrophenyl)-4,6-dioxo-2H-pyrrolo[3,4-c]pyrazole-3-carboxylate CAS Name: 5-(4-nitrophenyl)-4,6-dioxo-2H-pyrrolo[3,4-c]pyrazole-3-carboxylic acid methyl ester IUPAC Name: methyl 5-(4-nitrophenyl)-4,6-dioxo-2H-pyrrolo[3,4-c]pyrazole-3-carboxylate Traditional Name: 4,6-diketo-5-(4-nitrophenyl)-2H-pyrrolo[3,4-c]pyrazole-3-carboxylic acid methyl ester Formula: C13H8N4O6 MolecularWeight: 316.22582

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C(=NN1)C(=O)N(C2=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C2C(=NN1)C(=O)N(C2=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H8N4O6/c1-23-13(20)10-8-9(14-15-10)12(19)16(11(8)18)6-2-4-7(5-3-6)17(21)22/h2-5H,1H3,(H,14,15)