2-[3-[3,4-bis(oxidanyl)phenyl]propanoylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[3-[3,4-bis(oxidanyl)phenyl]propanoylamino]-3-oxidanyl-butanoic acid Openeye Name: 2-[3-(3,4-dihydroxyphenyl)propanoylamino]-3-hydroxy-butanoic acid CAS Name: 2-[[3-(3,4-dihydroxyphenyl)-1-oxopropyl]amino]-3-hydroxybutanoic acid IUPAC Name: 2-[3-(3,4-dihydroxyphenyl)propanoylamino]-3-hydroxybutanoic acid Traditional Name: 2-[3-(3,4-dihydroxyphenyl)propanoylamino]-3-hydroxy-butyric acid Formula: C13H17NO6 MolecularWeight: 283.27718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO6/c1-7(15)12(13(19)20)14-11(18)5-3-8-2-4-9(16)10(17)6-8/h2,4,6-7,12,15-17H,3,5H2,1H3,(H,14,18)(H,19,20)