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

Systemtic Name: 2-acetamido-2-[[3,4-bis(oxidanyl)phenyl]methyl]-3-oxidanyl-propanoic acid Openeye Name: 2-acetamido-2-[(3,4-dihydroxyphenyl)methyl]-3-hydroxy-propanoic acid CAS Name: 2-acetamido-2-[(3,4-dihydroxyphenyl)methyl]-3-hydroxypropanoic acid IUPAC Name: 2-acetamido-2-[(3,4-dihydroxyphenyl)methyl]-3-hydroxypropanoic acid Traditional Name: 2-acetamido-3-(3,4-dihydroxyphenyl)-2-methylol-propionic acid Formula: C12H15NO6 MolecularWeight: 269.2506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO6/c1-7(15)13-12(6-14,11(18)19)5-8-2-3-9(16)10(17)4-8/h2-4,14,16-17H,5-6H2,1H3,(H,13,15)(H,18,19)