methyl 4-[[3-(trifluoromethyl)phenyl]sulfonylamino]butanoate

Systemtic Name: methyl 4-[[3-(trifluoromethyl)phenyl]sulfonylamino]butanoate Openeye Name: methyl 4-[[3-(trifluoromethyl)phenyl]sulfonylamino]butanoate CAS Name: 4-[[3-(trifluoromethyl)phenyl]sulfonylamino]butanoic acid methyl ester IUPAC Name: methyl 4-[[3-(trifluoromethyl)phenyl]sulfonylamino]butanoate Traditional Name: 4-[[3-(trifluoromethyl)phenyl]sulfonylamino]butyric acid methyl ester Formula: C12H14F3NO4S MolecularWeight: 325.30407

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNS(=O)(=O)C1=CC=CC(=C1)C(F)(F)F

Isomeric SMILES

COC(=O)CCCNS(=O)(=O)C1=CC=CC(=C1)C(F)(F)F

InChI

InChI=1S/C12H14F3NO4S/c1-20-11(17)6-3-7-16-21(18,19)10-5-2-4-9(8-10)12(13,14)15/h2,4-5,8,16H,3,6-7H2,1H3