methyl (4S)-1-cyclopentyl-4-(cyclopropylcarbonylamino)-2-methyl-5-oxidanylidene-4-(trifluoromethyl)pyrrole-3-carboxylate

Systemtic Name: methyl (4S)-1-cyclopentyl-4-(cyclopropylcarbonylamino)-2-methyl-5-oxidanylidene-4-(trifluoromethyl)pyrrole-3-carboxylate Openeye Name: methyl (4S)-1-cyclopentyl-4-(cyclopropanecarbonylamino)-2-methyl-5-oxo-4-(trifluoromethyl)pyrrole-3-carboxylate CAS Name: (4S)-1-cyclopentyl-4-[[cyclopropyl(oxo)methyl]amino]-2-methyl-5-oxo-4-(trifluoromethyl)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4S)-1-cyclopentyl-4-(cyclopropanecarbonylamino)-2-methyl-5-oxo-4-(trifluoromethyl)pyrrole-3-carboxylate Traditional Name: (4S)-1-cyclopentyl-4-(cyclopropanecarbonylamino)-5-keto-2-methyl-4-(trifluoromethyl)-2-pyrroline-3-carboxylic acid methyl ester Formula: C17H21F3N2O4 MolecularWeight: 374.35485

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=O)N1C2CCCC2)(C(F)(F)F)NC(=O)C3CC3)C(=O)OC

Isomeric SMILES

CC1=C([C@](C(=O)N1C2CCCC2)(C(F)(F)F)NC(=O)C3CC3)C(=O)OC

InChI

InChI=1S/C17H21F3N2O4/c1-9-12(14(24)26-2)16(17(18,19)20,21-13(23)10-7-8-10)15(25)22(9)11-5-3-4-6-11/h10-11H,3-8H2,1-2H3,(H,21,23)/t16-/m0/s1