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

Systemtic Name: 2-azanyl-3-[2-[2,4-bis(oxidanyl)phenyl]carbonyl-4-oxidanyl-phenyl]propanoic acid Openeye Name: 2-amino-3-[2-(2,4-dihydroxybenzoyl)-4-hydroxy-phenyl]propanoic acid CAS Name: 2-amino-3-[2-[(2,4-dihydroxyphenyl)-oxomethyl]-4-hydroxyphenyl]propanoic acid IUPAC Name: 2-amino-3-[2-(2,4-dihydroxybenzoyl)-4-hydroxyphenyl]propanoic acid Traditional Name: 2-amino-3-[2-(2,4-dihydroxybenzoyl)-4-hydroxy-phenyl]propionic acid Formula: C16H15NO6 MolecularWeight: 317.2934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1O)C(=O)C2=C(C=C(C=C2)O)O)CC(C(=O)O)N

Isomeric SMILES

C1=CC(=C(C=C1O)C(=O)C2=C(C=C(C=C2)O)O)CC(C(=O)O)N

InChI

InChI=1S/C16H15NO6/c17-13(16(22)23)5-8-1-2-9(18)6-12(8)15(21)11-4-3-10(19)7-14(11)20/h1-4,6-7,13,18-20H,5,17H2,(H,22,23)