methyl (3S)-3-azanyl-3-(6-oxidanylidene-1H-pyridin-3-yl)propanoate

Systemtic Name: methyl (3S)-3-azanyl-3-(6-oxidanylidene-1H-pyridin-3-yl)propanoate Openeye Name: methyl (3S)-3-amino-3-(6-oxo-1H-pyridin-3-yl)propanoate CAS Name: (3S)-3-amino-3-(6-oxo-1H-pyridin-3-yl)propanoic acid methyl ester IUPAC Name: methyl (3S)-3-amino-3-(6-oxo-1H-pyridin-3-yl)propanoate Traditional Name: (3S)-3-amino-3-(6-keto-1H-pyridin-3-yl)propionic acid methyl ester Formula: C9H12N2O3 MolecularWeight: 196.20318

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CNC(=O)C=C1)N

Isomeric SMILES

COC(=O)C[C@@H](C1=CNC(=O)C=C1)N

InChI

InChI=1S/C9H12N2O3/c1-14-9(13)4-7(10)6-2-3-8(12)11-5-6/h2-3,5,7H,4,10H2,1H3,(H,11,12)/t7-/m0/s1