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

Systemtic Name: methyl (4S)-4-(cyclopropylcarbonylamino)-2-methyl-5-oxidanylidene-1-(phenylmethyl)-4-(trifluoromethyl)pyrrole-3-carboxylate Openeye Name: methyl (4S)-1-benzyl-4-(cyclopropanecarbonylamino)-2-methyl-5-oxo-4-(trifluoromethyl)pyrrole-3-carboxylate CAS Name: (4S)-4-[[cyclopropyl(oxo)methyl]amino]-2-methyl-5-oxo-1-(phenylmethyl)-4-(trifluoromethyl)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4S)-1-benzyl-4-(cyclopropanecarbonylamino)-2-methyl-5-oxo-4-(trifluoromethyl)pyrrole-3-carboxylate Traditional Name: (4S)-1-benzyl-4-(cyclopropanecarbonylamino)-5-keto-2-methyl-4-(trifluoromethyl)-2-pyrroline-3-carboxylic acid methyl ester Formula: C19H19F3N2O4 MolecularWeight: 396.36037

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=O)N1CC2=CC=CC=C2)(C(F)(F)F)NC(=O)C3CC3)C(=O)OC

Isomeric SMILES

CC1=C([C@](C(=O)N1CC2=CC=CC=C2)(C(F)(F)F)NC(=O)C3CC3)C(=O)OC

InChI

InChI=1S/C19H19F3N2O4/c1-11-14(16(26)28-2)18(19(20,21)22,23-15(25)13-8-9-13)17(27)24(11)10-12-6-4-3-5-7-12/h3-7,13H,8-10H2,1-2H3,(H,23,25)/t18-/m0/s1