4-[[2-chloranyl-5-(trifluoromethyl)phenyl]amino]butanoate

Systemtic Name: 4-[[2-chloranyl-5-(trifluoromethyl)phenyl]amino]butanoate Openeye Name: 4-[2-chloro-5-(trifluoromethyl)anilino]butanoate CAS Name: 4-[2-chloro-5-(trifluoromethyl)anilino]butanoate IUPAC Name: 4-[2-chloro-5-(trifluoromethyl)anilino]butanoate Traditional Name: 4-[2-chloro-5-(trifluoromethyl)anilino]butyrate Formula: C11H10ClF3NO2- MolecularWeight: 280.65081

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)NCCCC(=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)NCCCC(=O)[O-])Cl

InChI

InChI=1S/C11H11ClF3NO2/c12-8-4-3-7(11(13,14)15)6-9(8)16-5-1-2-10(17)18/h3-4,6,16H,1-2,5H2,(H,17,18)/p-1