2-[(3-hydroxyphenyl)-(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]propanoic acid

Systemtic Name: 2-[(3-hydroxyphenyl)-(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]propanoic acid Openeye Name: 2-(3-hydroxy-N-(2-hydroxy-1-methyl-2-oxo-ethyl)anilino)propanoic acid CAS Name: 2-(3-hydroxy-N-(1-hydroxy-1-oxopropan-2-yl)anilino)propanoic acid IUPAC Name: 2-(3-hydroxy-N-(1-hydroxy-1-oxopropan-2-yl)anilino)propanoic acid Traditional Name: 2-(3-hydroxy-N-(2-hydroxy-2-keto-1-methyl-ethyl)anilino)propionic acid Formula: C12H15NO5 MolecularWeight: 253.2512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(C1=CC(=CC=C1)O)C(C)C(=O)O

Isomeric SMILES

CC(C(=O)O)N(C1=CC(=CC=C1)O)C(C)C(=O)O

InChI

InChI=1S/C12H15NO5/c1-7(11(15)16)13(8(2)12(17)18)9-4-3-5-10(14)6-9/h3-8,14H,1-2H3,(H,15,16)(H,17,18)