methyl 2-(2-oxidanyl-4-oxidanylidene-1-phenethyl-pyridin-3-yl)ethanoate

Systemtic Name: methyl 2-(2-oxidanyl-4-oxidanylidene-1-phenethyl-pyridin-3-yl)ethanoate Openeye Name: methyl 2-(2-hydroxy-4-oxo-1-phenethyl-3-pyridyl)acetate CAS Name: 2-(2-hydroxy-4-oxo-1-phenethyl-3-pyridinyl)acetic acid methyl ester IUPAC Name: methyl 2-(2-hydroxy-4-oxo-1-phenethylpyridin-3-yl)acetate Traditional Name: 2-(2-hydroxy-4-keto-1-phenethyl-3-pyridyl)acetic acid methyl ester Formula: C16H17NO4 MolecularWeight: 287.31048

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=C(N(C=CC1=O)CCC2=CC=CC=C2)O

Isomeric SMILES

COC(=O)CC1=C(N(C=CC1=O)CCC2=CC=CC=C2)O

InChI

InChI=1S/C16H17NO4/c1-21-15(19)11-13-14(18)8-10-17(16(13)20)9-7-12-5-3-2-4-6-12/h2-6,8,10,20H,7,9,11H2,1H3