3,4-bis[(2-fluorophenyl)carbonylamino]benzoic acid

Systemtic Name: 3,4-bis[(2-fluorophenyl)carbonylamino]benzoic acid Openeye Name: 3,4-bis[(2-fluorobenzoyl)amino]benzoic acid CAS Name: 3,4-bis[[(2-fluorophenyl)-oxomethyl]amino]benzoic acid IUPAC Name: 3,4-bis[(2-fluorobenzoyl)amino]benzoic acid Traditional Name: 3,4-bis[(2-fluorobenzoyl)amino]benzoic acid Formula: C21H14F2N2O4 MolecularWeight: 396.343666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=C(C=C(C=C2)C(=O)O)NC(=O)C3=CC=CC=C3F)F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=C(C=C(C=C2)C(=O)O)NC(=O)C3=CC=CC=C3F)F

InChI

InChI=1S/C21H14F2N2O4/c22-15-7-3-1-5-13(15)19(26)24-17-10-9-12(21(28)29)11-18(17)25-20(27)14-6-2-4-8-16(14)23/h1-11H,(H,24,26)(H,25,27)(H,28,29)