2-acetamido-3-[3,4-bis(oxidanyl)phenyl]propanoic acid

Systemtic Name: 2-acetamido-3-[3,4-bis(oxidanyl)phenyl]propanoic acid Openeye Name: 2-acetamido-3-(3,4-dihydroxyphenyl)propanoic acid CAS Name: 2-acetamido-3-(3,4-dihydroxyphenyl)propanoic acid IUPAC Name: 2-acetamido-3-(3,4-dihydroxyphenyl)propanoic acid Traditional Name: 2-acetamido-3-(3,4-dihydroxyphenyl)propionic acid Formula: C11H13NO5 MolecularWeight: 239.22462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC(=C(C=C1)O)O)C(=O)O

Isomeric SMILES

CC(=O)NC(CC1=CC(=C(C=C1)O)O)C(=O)O

InChI

InChI=1S/C11H13NO5/c1-6(13)12-8(11(16)17)4-7-2-3-9(14)10(15)5-7/h2-3,5,8,14-15H,4H2,1H3,(H,12,13)(H,16,17)