methyl 3-methoxy-4-[(6-nitro-3-oxidanylidene-2H-indazol-1-yl)methyl]benzoate

Systemtic Name: methyl 3-methoxy-4-[(6-nitro-3-oxidanylidene-2H-indazol-1-yl)methyl]benzoate Openeye Name: methyl 3-methoxy-4-[(6-nitro-3-oxo-2H-indazol-1-yl)methyl]benzoate CAS Name: 3-methoxy-4-[(6-nitro-3-oxo-2H-indazol-1-yl)methyl]benzoic acid methyl ester IUPAC Name: methyl 3-methoxy-4-[(6-nitro-3-oxo-2H-indazol-1-yl)methyl]benzoate Traditional Name: 4-[(3-keto-6-nitro-indazolin-1-yl)methyl]-3-methoxy-benzoic acid methyl ester Formula: C17H15N3O6 MolecularWeight: 357.3175

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC)CN2C3=C(C=CC(=C3)[N+](=O)[O-])C(=O)N2

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC)CN2C3=C(C=CC(=C3)[N+](=O)[O-])C(=O)N2

InChI

InChI=1S/C17H15N3O6/c1-25-15-7-10(17(22)26-2)3-4-11(15)9-19-14-8-12(20(23)24)5-6-13(14)16(21)18-19/h3-8H,9H2,1-2H3,(H,18,21)