4-[2-(2-chloranyl-6-fluoranyl-phenyl)ethanoylamino]butanoate

Systemtic Name: 4-[2-(2-chloranyl-6-fluoranyl-phenyl)ethanoylamino]butanoate Openeye Name: 4-[[2-(2-chloro-6-fluoro-phenyl)acetyl]amino]butanoate CAS Name: 4-[[2-(2-chloro-6-fluorophenyl)-1-oxoethyl]amino]butanoate IUPAC Name: 4-[[2-(2-chloro-6-fluorophenyl)acetyl]amino]butanoate Traditional Name: 4-[[2-(2-chloro-6-fluoro-phenyl)acetyl]amino]butyrate Formula: C12H12ClFNO3- MolecularWeight: 272.679983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CC(=O)NCCCC(=O)[O-])F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CC(=O)NCCCC(=O)[O-])F

InChI

InChI=1S/C12H13ClFNO3/c13-9-3-1-4-10(14)8(9)7-11(16)15-6-2-5-12(17)18/h1,3-4H,2,5-7H2,(H,15,16)(H,17,18)/p-1