(1-azanyl-1-oxidanylidene-propan-2-yl) 3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoate CAS Name: 3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]pentanoate Traditional Name: 3-methyl-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]valeric acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C16H21F3N2O5S MolecularWeight: 410.40855

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC(C)C(=O)N)NS(=O)(=O)C1=CC=CC(=C1)C(F)(F)F

Isomeric SMILES

CCC(C)C(C(=O)OC(C)C(=O)N)NS(=O)(=O)C1=CC=CC(=C1)C(F)(F)F

InChI

InChI=1S/C16H21F3N2O5S/c1-4-9(2)13(15(23)26-10(3)14(20)22)21-27(24,25)12-7-5-6-11(8-12)16(17,18)19/h5-10,13,21H,4H2,1-3H3,(H2,20,22)