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

Systemtic Name: 6-[[2-chloranyl-5-(trifluoromethyl)phenyl]amino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-[2-chloro-5-(trifluoromethyl)anilino]-6-oxo-hexanoic acid CAS Name: 6-[2-chloro-5-(trifluoromethyl)anilino]-6-oxohexanoic acid IUPAC Name: 6-[2-chloro-5-(trifluoromethyl)anilino]-6-oxohexanoic acid Traditional Name: 6-[2-chloro-5-(trifluoromethyl)anilino]-6-keto-hexanoic acid Formula: C13H13ClF3NO3 MolecularWeight: 323.69543

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13ClF3NO3/c14-9-6-5-8(13(15,16)17)7-10(9)18-11(19)3-1-2-4-12(20)21/h5-7H,1-4H2,(H,18,19)(H,20,21)