ethyl (4S)-1-cyclohexyl-4-[(2-methoxyphenyl)carbonylamino]-2-methyl-5-oxidanylidene-4-(trifluoromethyl)pyrrole-3-carboxylate

Systemtic Name: ethyl (4S)-1-cyclohexyl-4-[(2-methoxyphenyl)carbonylamino]-2-methyl-5-oxidanylidene-4-(trifluoromethyl)pyrrole-3-carboxylate Openeye Name: ethyl (4S)-1-cyclohexyl-4-[(2-methoxybenzoyl)amino]-2-methyl-5-oxo-4-(trifluoromethyl)pyrrole-3-carboxylate CAS Name: (4S)-1-cyclohexyl-4-[[(2-methoxyphenyl)-oxomethyl]amino]-2-methyl-5-oxo-4-(trifluoromethyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl (4S)-1-cyclohexyl-4-[(2-methoxybenzoyl)amino]-2-methyl-5-oxo-4-(trifluoromethyl)pyrrole-3-carboxylate Traditional Name: (4S)-1-cyclohexyl-5-keto-2-methyl-4-(o-anisoylamino)-4-(trifluoromethyl)-2-pyrroline-3-carboxylic acid ethyl ester Formula: C23H27F3N2O5 MolecularWeight: 468.46609

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)C1(C(F)(F)F)NC(=O)C2=CC=CC=C2OC)C3CCCCC3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)[C@@]1(C(F)(F)F)NC(=O)C2=CC=CC=C2OC)C3CCCCC3)C

InChI

InChI=1S/C23H27F3N2O5/c1-4-33-20(30)18-14(2)28(15-10-6-5-7-11-15)21(31)22(18,23(24,25)26)27-19(29)16-12-8-9-13-17(16)32-3/h8-9,12-13,15H,4-7,10-11H2,1-3H3,(H,27,29)/t22-/m0/s1