methyl (4R)-4-acetamido-2-methyl-5-oxidanylidene-1-propyl-4-(trifluoromethyl)pyrrole-3-carboxylate

Systemtic Name: methyl (4R)-4-acetamido-2-methyl-5-oxidanylidene-1-propyl-4-(trifluoromethyl)pyrrole-3-carboxylate Openeye Name: methyl (4R)-4-acetamido-2-methyl-5-oxo-1-propyl-4-(trifluoromethyl)pyrrole-3-carboxylate CAS Name: (4R)-4-acetamido-2-methyl-5-oxo-1-propyl-4-(trifluoromethyl)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4R)-4-acetamido-2-methyl-5-oxo-1-propyl-4-(trifluoromethyl)pyrrole-3-carboxylate Traditional Name: (4R)-4-acetamido-5-keto-2-methyl-1-propyl-4-(trifluoromethyl)-2-pyrroline-3-carboxylic acid methyl ester Formula: C13H17F3N2O4 MolecularWeight: 322.28029

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(C1=O)(C(F)(F)F)NC(=O)C)C(=O)OC)C

Isomeric SMILES

CCCN1C(=C([C@@](C1=O)(C(F)(F)F)NC(=O)C)C(=O)OC)C

InChI

InChI=1S/C13H17F3N2O4/c1-5-6-18-7(2)9(10(20)22-4)12(11(18)21,13(14,15)16)17-8(3)19/h5-6H2,1-4H3,(H,17,19)/t12-/m1/s1