methyl 3,5-dinitro-4-(pyridin-2-ylamino)benzoate

Systemtic Name: methyl 3,5-dinitro-4-(pyridin-2-ylamino)benzoate Openeye Name: methyl 3,5-dinitro-4-(2-pyridylamino)benzoate CAS Name: 3,5-dinitro-4-(2-pyridinylamino)benzoic acid methyl ester IUPAC Name: methyl 3,5-dinitro-4-(pyridin-2-ylamino)benzoate Traditional Name: 3,5-dinitro-4-(2-pyridylamino)benzoic acid methyl ester Formula: C13H10N4O6 MolecularWeight: 318.2417

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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