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

Systemtic Name: 5-[[2-chloranyl-5-(trifluoromethyl)phenyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[2-chloro-5-(trifluoromethyl)anilino]-5-oxo-pentanoic acid CAS Name: 5-[2-chloro-5-(trifluoromethyl)anilino]-5-oxopentanoic acid IUPAC Name: 5-[2-chloro-5-(trifluoromethyl)anilino]-5-oxopentanoic acid Traditional Name: 5-[2-chloro-5-(trifluoromethyl)anilino]-5-keto-valeric acid Formula: C12H11ClF3NO3 MolecularWeight: 309.66885

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11ClF3NO3/c13-8-5-4-7(12(14,15)16)6-9(8)17-10(18)2-1-3-11(19)20/h4-6H,1-3H2,(H,17,18)(H,19,20)