methyl 3-oxidanyl-2-(3-pyridin-3-ylpropanoylamino)propanoate

Systemtic Name: methyl 3-oxidanyl-2-(3-pyridin-3-ylpropanoylamino)propanoate Openeye Name: methyl 3-hydroxy-2-[3-(3-pyridyl)propanoylamino]propanoate CAS Name: 3-hydroxy-2-[[1-oxo-3-(3-pyridinyl)propyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-(3-pyridin-3-ylpropanoylamino)propanoate Traditional Name: 3-hydroxy-2-[3-(3-pyridyl)propanoylamino]propionic acid methyl ester Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)CCC1=CN=CC=C1

Isomeric SMILES

COC(=O)C(CO)NC(=O)CCC1=CN=CC=C1

InChI

InChI=1S/C12H16N2O4/c1-18-12(17)10(8-15)14-11(16)5-4-9-3-2-6-13-7-9/h2-3,6-7,10,15H,4-5,8H2,1H3,(H,14,16)