ethyl 6-oxidanyl-4-oxidanylidene-1-(phenylmethyl)-3H-pyridin-1-ium-3-carboxylate

Systemtic Name: ethyl 6-oxidanyl-4-oxidanylidene-1-(phenylmethyl)-3H-pyridin-1-ium-3-carboxylate Openeye Name: ethyl 1-benzyl-6-hydroxy-4-oxo-3H-pyridin-1-ium-3-carboxylate CAS Name: 6-hydroxy-4-oxo-1-(phenylmethyl)-3H-pyridin-1-ium-3-carboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-6-hydroxy-4-oxo-3H-pyridin-1-ium-3-carboxylate Traditional Name: 1-benzyl-6-hydroxy-4-keto-3H-pyridin-1-ium-3-carboxylic acid ethyl ester Formula: C15H16NO4+ MolecularWeight: 274.29184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C=[N+](C(=CC1=O)O)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1C=[N+](C(=CC1=O)O)CC2=CC=CC=C2

InChI

InChI=1S/C15H15NO4/c1-2-20-15(19)12-10-16(14(18)8-13(12)17)9-11-6-4-3-5-7-11/h3-8,10,12H,2,9H2,1H3/p+1