2-[[4-(4-carboxyphenyl)-3-phenoxy-phenyl]carbonylamino]benzoic acid

Systemtic Name: 2-[[4-(4-carboxyphenyl)-3-phenoxy-phenyl]carbonylamino]benzoic acid Openeye Name: 2-[[4-(4-carboxyphenyl)-3-phenoxy-benzoyl]amino]benzoic acid CAS Name: 2-[[[4-(4-carboxyphenyl)-3-phenoxyphenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[[4-(4-carboxyphenyl)-3-phenoxybenzoyl]amino]benzoic acid Traditional Name: 2-[[4-(4-carboxyphenyl)-3-phenoxy-benzoyl]amino]benzoic acid Formula: C27H19NO6 MolecularWeight: 453.44286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=C(C=CC(=C2)C(=O)NC3=CC=CC=C3C(=O)O)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC2=C(C=CC(=C2)C(=O)NC3=CC=CC=C3C(=O)O)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C27H19NO6/c29-25(28-23-9-5-4-8-22(23)27(32)33)19-14-15-21(17-10-12-18(13-11-17)26(30)31)24(16-19)34-20-6-2-1-3-7-20/h1-16H,(H,28,29)(H,30,31)(H,32,33)