(2R,3S)-3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoate

Systemtic Name: (2R,3S)-3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoate Openeye Name: (2R,3S)-3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoate CAS Name: (2R,3S)-3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoate IUPAC Name: (2R,3S)-3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoate Traditional Name: (2R,3S)-3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]valerate Formula: C13H15F3NO4S- MolecularWeight: 338.32271

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NS(=O)(=O)C1=CC=CC(=C1)C(F)(F)F

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)[O-])NS(=O)(=O)C1=CC=CC(=C1)C(F)(F)F

InChI

InChI=1S/C13H16F3NO4S/c1-3-8(2)11(12(18)19)17-22(20,21)10-6-4-5-9(7-10)13(14,15)16/h4-8,11,17H,3H2,1-2H3,(H,18,19)/p-1/t8-,11+/m0/s1