6-[[2-chloranyl-3,5-bis(trifluoromethyl)phenyl]amino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[[2-chloranyl-3,5-bis(trifluoromethyl)phenyl]amino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-[2-chloro-3,5-bis(trifluoromethyl)anilino]-6-oxo-hexanoic acid CAS Name: 6-[2-chloro-3,5-bis(trifluoromethyl)anilino]-6-oxohexanoic acid IUPAC Name: 6-[2-chloro-3,5-bis(trifluoromethyl)anilino]-6-oxohexanoic acid Traditional Name: 6-[2-chloro-3,5-bis(trifluoromethyl)anilino]-6-keto-hexanoic acid Formula: C14H12ClF6NO3 MolecularWeight: 391.693399

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1C(F)(F)F)Cl)NC(=O)CCCCC(=O)O)C(F)(F)F

Isomeric SMILES

C1=C(C=C(C(=C1C(F)(F)F)Cl)NC(=O)CCCCC(=O)O)C(F)(F)F

InChI

InChI=1S/C14H12ClF6NO3/c15-12-8(14(19,20)21)5-7(13(16,17)18)6-9(12)22-10(23)3-1-2-4-11(24)25/h5-6H,1-4H2,(H,22,23)(H,24,25)