methyl 2-[1-[2-(1H-imidazol-5-yl)ethyl]-2-oxidanyl-4-oxidanylidene-pyridin-3-yl]ethanoate

Systemtic Name: methyl 2-[1-[2-(1H-imidazol-5-yl)ethyl]-2-oxidanyl-4-oxidanylidene-pyridin-3-yl]ethanoate Openeye Name: methyl 2-[2-hydroxy-1-[2-(1H-imidazol-5-yl)ethyl]-4-oxo-3-pyridyl]acetate CAS Name: 2-[2-hydroxy-1-[2-(1H-imidazol-5-yl)ethyl]-4-oxo-3-pyridinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-hydroxy-1-[2-(1H-imidazol-5-yl)ethyl]-4-oxopyridin-3-yl]acetate Traditional Name: 2-[2-hydroxy-1-[2-(1H-imidazol-5-yl)ethyl]-4-keto-3-pyridyl]acetic acid methyl ester Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=C(N(C=CC1=O)CCC2=CN=CN2)O

Isomeric SMILES

COC(=O)CC1=C(N(C=CC1=O)CCC2=CN=CN2)O

InChI

InChI=1S/C13H15N3O4/c1-20-12(18)6-10-11(17)3-5-16(13(10)19)4-2-9-7-14-8-15-9/h3,5,7-8,19H,2,4,6H2,1H3,(H,14,15)