(phenylmethyl) 3-azanyl-2-nitro-pyridine-4-carboxylate

Systemtic Name: (phenylmethyl) 3-azanyl-2-nitro-pyridine-4-carboxylate Openeye Name: benzyl 3-amino-2-nitro-pyridine-4-carboxylate CAS Name: 3-amino-2-nitro-4-pyridinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-amino-2-nitropyridine-4-carboxylate Traditional Name: 3-amino-2-nitro-isonicotinic acid benzyl ester Formula: C13H11N3O4 MolecularWeight: 273.24414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11N3O4/c14-11-10(6-7-15-12(11)16(18)19)13(17)20-8-9-4-2-1-3-5-9/h1-7H,8,14H2