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

Systemtic Name: methyl (2R)-2-[[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonylamino]-4-methyl-pentanoate Openeye Name: methyl (2R)-2-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-4-methyl-pentanoate CAS Name: (2R)-2-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-4-methylpentanoate Traditional Name: (2R)-2-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-4-methyl-valeric acid methyl ester Formula: C14H17ClF3NO4S MolecularWeight: 387.80229

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NS(=O)(=O)C1=CC(=C(C=C1)Cl)C(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C14H17ClF3NO4S/c1-8(2)6-12(13(20)23-3)19-24(21,22)9-4-5-11(15)10(7-9)14(16,17)18/h4-5,7-8,12,19H,6H2,1-3H3/t12-/m1/s1