6-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[(3-chloranyl-4-fluoranyl-phenyl)amino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-(3-chloro-4-fluoro-anilino)-6-oxo-hexanoic acid CAS Name: 6-(3-chloro-4-fluoroanilino)-6-oxohexanoic acid IUPAC Name: 6-(3-chloro-4-fluoroanilino)-6-oxohexanoic acid Traditional Name: 6-(3-chloro-4-fluoro-anilino)-6-keto-hexanoic acid Formula: C12H13ClFNO3 MolecularWeight: 273.687923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)CCCCC(=O)O)Cl)F

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)CCCCC(=O)O)Cl)F

InChI

InChI=1S/C12H13ClFNO3/c13-9-7-8(5-6-10(9)14)15-11(16)3-1-2-4-12(17)18/h5-7H,1-4H2,(H,15,16)(H,17,18)