3-[2-[2,4,6-tris(oxidanyl)phenyl]ethanoylamino]benzoic acid

Systemtic Name: 3-[2-[2,4,6-tris(oxidanyl)phenyl]ethanoylamino]benzoic acid Openeye Name: 3-[[2-(2,4,6-trihydroxyphenyl)acetyl]amino]benzoic acid CAS Name: 3-[[1-oxo-2-(2,4,6-trihydroxyphenyl)ethyl]amino]benzoic acid IUPAC Name: 3-[[2-(2,4,6-trihydroxyphenyl)acetyl]amino]benzoic acid Traditional Name: 3-[[2-(2,4,6-trihydroxyphenyl)acetyl]amino]benzoic acid Formula: C15H13NO6 MolecularWeight: 303.26682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CC2=C(C=C(C=C2O)O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CC2=C(C=C(C=C2O)O)O)C(=O)O

InChI

InChI=1S/C15H13NO6/c17-10-5-12(18)11(13(19)6-10)7-14(20)16-9-3-1-2-8(4-9)15(21)22/h1-6,17-19H,7H2,(H,16,20)(H,21,22)