methyl 3-[2-(5-azanyl-2-oxidanylidene-pyridin-1-yl)ethylsulfonyl]propanoate

Systemtic Name: methyl 3-[2-(5-azanyl-2-oxidanylidene-pyridin-1-yl)ethylsulfonyl]propanoate Openeye Name: methyl 3-[2-(5-amino-2-oxo-1-pyridyl)ethylsulfonyl]propanoate CAS Name: 3-[2-(5-amino-2-oxo-1-pyridinyl)ethylsulfonyl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(5-amino-2-oxopyridin-1-yl)ethylsulfonyl]propanoate Traditional Name: 3-[2-(5-amino-2-keto-1-pyridyl)ethylsulfonyl]propionic acid methyl ester Formula: C11H16N2O5S MolecularWeight: 288.32014

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCS(=O)(=O)CCN1C=C(C=CC1=O)N

Isomeric SMILES

COC(=O)CCS(=O)(=O)CCN1C=C(C=CC1=O)N

InChI

InChI=1S/C11H16N2O5S/c1-18-11(15)4-6-19(16,17)7-5-13-8-9(12)2-3-10(13)14/h2-3,8H,4-7,12H2,1H3