4-[[(4-chloranyl-2-fluoranyl-phenyl)carbamoylamino]methyl]benzoic acid

Systemtic Name: 4-[[(4-chloranyl-2-fluoranyl-phenyl)carbamoylamino]methyl]benzoic acid Openeye Name: 4-[[(4-chloro-2-fluoro-phenyl)carbamoylamino]methyl]benzoic acid CAS Name: 4-[[[(4-chloro-2-fluoroanilino)-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[(4-chloro-2-fluorophenyl)carbamoylamino]methyl]benzoic acid Traditional Name: 4-[[(4-chloro-2-fluoro-phenyl)carbamoylamino]methyl]benzoic acid Formula: C15H12ClFN2O3 MolecularWeight: 322.718783

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)NC2=C(C=C(C=C2)Cl)F)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)NC2=C(C=C(C=C2)Cl)F)C(=O)O

InChI

InChI=1S/C15H12ClFN2O3/c16-11-5-6-13(12(17)7-11)19-15(22)18-8-9-1-3-10(4-2-9)14(20)21/h1-7H,8H2,(H,20,21)(H2,18,19,22)