O1-tert-butyl O6-methyl 6-(trifluoromethyl)-2,5-dihydropyridine-1,6-dicarboxylate

Systemtic Name: O1-tert-butyl O6-methyl 6-(trifluoromethyl)-2,5-dihydropyridine-1,6-dicarboxylate Openeye Name: O1-tert-butyl O6-methyl 6-(trifluoromethyl)-2,5-dihydropyridine-1,6-dicarboxylate CAS Name: 6-(trifluoromethyl)-2,5-dihydropyridine-1,6-dicarboxylic acid O1-tert-butyl ester O6-methyl ester IUPAC Name: 1-O-tert-butyl 6-O-methyl 6-(trifluoromethyl)-2,5-dihydropyridine-1,6-dicarboxylate Traditional Name: 6-(trifluoromethyl)-2,5-dihydropyridine-1,6-dicarboxylic acid O1-tert-butyl ester O6-methyl ester Formula: C13H18F3NO4 MolecularWeight: 309.28153

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC=CCC1(C(=O)OC)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CC=CCC1(C(=O)OC)C(F)(F)F

InChI

InChI=1S/C13H18F3NO4/c1-11(2,3)21-10(19)17-8-6-5-7-12(17,9(18)20-4)13(14,15)16/h5-6H,7-8H2,1-4H3