methyl 2-[3-[3,4-bis(oxidanyl)phenyl]propanoylamino]propanoate

Systemtic Name: methyl 2-[3-[3,4-bis(oxidanyl)phenyl]propanoylamino]propanoate Openeye Name: methyl 2-[3-(3,4-dihydroxyphenyl)propanoylamino]propanoate CAS Name: 2-[[3-(3,4-dihydroxyphenyl)-1-oxopropyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-[3-(3,4-dihydroxyphenyl)propanoylamino]propanoate Traditional Name: 2-[3-(3,4-dihydroxyphenyl)propanoylamino]propionic acid methyl ester Formula: C13H17NO5 MolecularWeight: 267.27778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC(=O)CCC1=CC(=C(C=C1)O)O

Isomeric SMILES

CC(C(=O)OC)NC(=O)CCC1=CC(=C(C=C1)O)O

InChI

InChI=1S/C13H17NO5/c1-8(13(18)19-2)14-12(17)6-4-9-3-5-10(15)11(16)7-9/h3,5,7-8,15-16H,4,6H2,1-2H3,(H,14,17)