methyl 2-[(3,5-dinitropyridin-2-yl)amino]benzoate

Systemtic Name: methyl 2-[(3,5-dinitropyridin-2-yl)amino]benzoate Openeye Name: methyl 2-[(3,5-dinitro-2-pyridyl)amino]benzoate CAS Name: 2-[(3,5-dinitro-2-pyridinyl)amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(3,5-dinitropyridin-2-yl)amino]benzoate Traditional Name: 2-[(3,5-dinitro-2-pyridyl)amino]benzoic acid methyl ester Formula: C13H10N4O6 MolecularWeight: 318.2417

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC2=C(C=C(C=N2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC2=C(C=C(C=N2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H10N4O6/c1-23-13(18)9-4-2-3-5-10(9)15-12-11(17(21)22)6-8(7-14-12)16(19)20/h2-7H,1H3,(H,14,15)