(6-methyl-3-nitro-2-oxidanylidene-1H-pyridin-4-yl) benzoate

Systemtic Name: (6-methyl-3-nitro-2-oxidanylidene-1H-pyridin-4-yl) benzoate Openeye Name: (6-methyl-3-nitro-2-oxo-1H-pyridin-4-yl) benzoate CAS Name: benzoic acid (6-methyl-3-nitro-2-oxo-1H-pyridin-4-yl) ester IUPAC Name: (6-methyl-3-nitro-2-oxo-1H-pyridin-4-yl) benzoate Traditional Name: benzoic acid (2-keto-6-methyl-3-nitro-1H-pyridin-4-yl) ester Formula: C13H10N2O5 MolecularWeight: 274.2289

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1)[N+](=O)[O-])OC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(C(=O)N1)[N+](=O)[O-])OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H10N2O5/c1-8-7-10(11(15(18)19)12(16)14-8)20-13(17)9-5-3-2-4-6-9/h2-7H,1H3,(H,14,16)