8-[(2-chloranyl-4-fluoranyl-phenyl)carbonylamino]octanoic acid

Systemtic Name: 8-[(2-chloranyl-4-fluoranyl-phenyl)carbonylamino]octanoic acid Openeye Name: 8-[(2-chloro-4-fluoro-benzoyl)amino]octanoic acid CAS Name: 8-[[(2-chloro-4-fluorophenyl)-oxomethyl]amino]octanoic acid IUPAC Name: 8-[(2-chloro-4-fluorobenzoyl)amino]octanoic acid Traditional Name: 8-[(2-chloro-4-fluoro-benzoyl)amino]caprylic acid Formula: C15H19ClFNO3 MolecularWeight: 315.767663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)Cl)C(=O)NCCCCCCCC(=O)O

Isomeric SMILES

C1=CC(=C(C=C1F)Cl)C(=O)NCCCCCCCC(=O)O

InChI

InChI=1S/C15H19ClFNO3/c16-13-10-11(17)7-8-12(13)15(21)18-9-5-3-1-2-4-6-14(19)20/h7-8,10H,1-6,9H2,(H,18,21)(H,19,20)