ethyl 1-cyclohexyl-2-methyl-5-oxidanylidene-4-(pentanoylamino)-4-(trifluoromethyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 1-cyclohexyl-2-methyl-5-oxidanylidene-4-(pentanoylamino)-4-(trifluoromethyl)pyrrole-3-carboxylate Openeye Name: ethyl 1-cyclohexyl-2-methyl-5-oxo-4-(pentanoylamino)-4-(trifluoromethyl)pyrrole-3-carboxylate CAS Name: 1-cyclohexyl-2-methyl-5-oxo-4-(1-oxopentylamino)-4-(trifluoromethyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyclohexyl-2-methyl-5-oxo-4-(pentanoylamino)-4-(trifluoromethyl)pyrrole-3-carboxylate Traditional Name: 1-cyclohexyl-5-keto-2-methyl-4-(trifluoromethyl)-4-(valerylamino)-2-pyrroline-3-carboxylic acid ethyl ester Formula: C20H29F3N2O4 MolecularWeight: 418.45047

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1(C(=C(N(C1=O)C2CCCCC2)C)C(=O)OCC)C(F)(F)F

Isomeric SMILES

CCCCC(=O)NC1(C(=C(N(C1=O)C2CCCCC2)C)C(=O)OCC)C(F)(F)F

InChI

InChI=1S/C20H29F3N2O4/c1-4-6-12-15(26)24-19(20(21,22)23)16(17(27)29-5-2)13(3)25(18(19)28)14-10-8-7-9-11-14/h14H,4-12H2,1-3H3,(H,24,26)