methyl 3-azanyl-5-[(3-nitropyridin-2-yl)amino]benzoate

Systemtic Name: methyl 3-azanyl-5-[(3-nitropyridin-2-yl)amino]benzoate Openeye Name: methyl 3-amino-5-[(3-nitro-2-pyridyl)amino]benzoate CAS Name: 3-amino-5-[(3-nitro-2-pyridinyl)amino]benzoic acid methyl ester IUPAC Name: methyl 3-amino-5-[(3-nitropyridin-2-yl)amino]benzoate Traditional Name: 3-amino-5-[(3-nitro-2-pyridyl)amino]benzoic acid methyl ester Formula: C13H12N4O4 MolecularWeight: 288.25878

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC2=C(C=CC=N2)[N+](=O)[O-])N

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC2=C(C=CC=N2)[N+](=O)[O-])N

InChI

InChI=1S/C13H12N4O4/c1-21-13(18)8-5-9(14)7-10(6-8)16-12-11(17(19)20)3-2-4-15-12/h2-7H,14H2,1H3,(H,15,16)