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

Systemtic Name: methyl 3-(1-oxidanylidene-2H-pyridin-1-ium-4-yl)benzoate Openeye Name: methyl 3-(1-oxo-2H-pyridin-1-ium-4-yl)benzoate CAS Name: 3-(1-oxo-2H-pyridin-1-ium-4-yl)benzoic acid methyl ester IUPAC Name: methyl 3-(1-oxo-2H-pyridin-1-ium-4-yl)benzoate Traditional Name: 3-(1-keto-2H-pyridin-1-ium-4-yl)benzoic acid methyl ester Formula: C13H12NO3+ MolecularWeight: 230.23928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12NO3/c1-17-13(15)12-4-2-3-11(9-12)10-5-7-14(16)8-6-10/h2-7,9H,8H2,1H3/q+1