methyl 4-methyl-2-[2-[[3-(trifluoromethyl)phenyl]sulfonylamino]ethanoylamino]pentanoate

Systemtic Name: methyl 4-methyl-2-[2-[[3-(trifluoromethyl)phenyl]sulfonylamino]ethanoylamino]pentanoate Openeye Name: methyl 4-methyl-2-[[2-[[3-(trifluoromethyl)phenyl]sulfonylamino]acetyl]amino]pentanoate CAS Name: 4-methyl-2-[[1-oxo-2-[[3-(trifluoromethyl)phenyl]sulfonylamino]ethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 4-methyl-2-[[2-[[3-(trifluoromethyl)phenyl]sulfonylamino]acetyl]amino]pentanoate Traditional Name: 4-methyl-2-[[2-[[3-(trifluoromethyl)phenyl]sulfonylamino]acetyl]amino]valeric acid methyl ester Formula: C16H21F3N2O5S MolecularWeight: 410.40855

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)CNS(=O)(=O)C1=CC=CC(=C1)C(F)(F)F

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)CNS(=O)(=O)C1=CC=CC(=C1)C(F)(F)F

InChI

InChI=1S/C16H21F3N2O5S/c1-10(2)7-13(15(23)26-3)21-14(22)9-20-27(24,25)12-6-4-5-11(8-12)16(17,18)19/h4-6,8,10,13,20H,7,9H2,1-3H3,(H,21,22)