methyl 4-(5-nitropyridin-2-yl)benzoate

Systemtic Name: methyl 4-(5-nitropyridin-2-yl)benzoate Openeye Name: methyl 4-(5-nitro-2-pyridyl)benzoate CAS Name: 4-(5-nitro-2-pyridinyl)benzoic acid methyl ester IUPAC Name: methyl 4-(5-nitropyridin-2-yl)benzoate Traditional Name: 4-(5-nitro-2-pyridyl)benzoic acid methyl ester Formula: C13H10N2O4 MolecularWeight: 258.2295

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H10N2O4/c1-19-13(16)10-4-2-9(3-5-10)12-7-6-11(8-14-12)15(17)18/h2-8H,1H3