methyl (3S,4R)-4-[(4-acetamidophenyl)sulfonylamino]-2-methylidene-5-oxidanylidene-4-(trifluoromethyl)pyrrolidine-3-carboxylate

Systemtic Name: methyl (3S,4R)-4-[(4-acetamidophenyl)sulfonylamino]-2-methylidene-5-oxidanylidene-4-(trifluoromethyl)pyrrolidine-3-carboxylate Openeye Name: methyl (3S,4R)-4-[(4-acetamidophenyl)sulfonylamino]-2-methylene-5-oxo-4-(trifluoromethyl)pyrrolidine-3-carboxylate CAS Name: (3S,4R)-4-[(4-acetamidophenyl)sulfonylamino]-2-methylene-5-oxo-4-(trifluoromethyl)-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (3S,4R)-4-[(4-acetamidophenyl)sulfonylamino]-2-methylidene-5-oxo-4-(trifluoromethyl)pyrrolidine-3-carboxylate Traditional Name: (3S,4R)-4-[(4-acetamidophenyl)sulfonylamino]-5-keto-2-methylene-4-(trifluoromethyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C16H16F3N3O6S MolecularWeight: 435.37495

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2(C(C(=C)NC2=O)C(=O)OC)C(F)(F)F

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N[C@@]2([C@H](C(=C)NC2=O)C(=O)OC)C(F)(F)F

InChI

InChI=1S/C16H16F3N3O6S/c1-8-12(13(24)28-3)15(14(25)20-8,16(17,18)19)22-29(26,27)11-6-4-10(5-7-11)21-9(2)23/h4-7,12,22H,1H2,2-3H3,(H,20,25)(H,21,23)/t12-,15-/m1/s1