4-[[2-(2-chloranyl-6-fluoranyl-phenyl)ethanoylamino]methyl]benzoic acid

Systemtic Name: 4-[[2-(2-chloranyl-6-fluoranyl-phenyl)ethanoylamino]methyl]benzoic acid Openeye Name: 4-[[[2-(2-chloro-6-fluoro-phenyl)acetyl]amino]methyl]benzoic acid CAS Name: 4-[[[2-(2-chloro-6-fluorophenyl)-1-oxoethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[2-(2-chloro-6-fluorophenyl)acetyl]amino]methyl]benzoic acid Traditional Name: 4-[[[2-(2-chloro-6-fluoro-phenyl)acetyl]amino]methyl]benzoic acid Formula: C16H13ClFNO3 MolecularWeight: 321.730723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CC(=O)NCC2=CC=C(C=C2)C(=O)O)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CC(=O)NCC2=CC=C(C=C2)C(=O)O)F

InChI

InChI=1S/C16H13ClFNO3/c17-13-2-1-3-14(18)12(13)8-15(20)19-9-10-4-6-11(7-5-10)16(21)22/h1-7H,8-9H2,(H,19,20)(H,21,22)