ditert-butyl 2-(hydroxymethyl)-2-methyl-6-pyridin-2-yl-1,3-dihydropyridine-4,4-dicarboxylate

Systemtic Name: ditert-butyl 2-(hydroxymethyl)-2-methyl-6-pyridin-2-yl-1,3-dihydropyridine-4,4-dicarboxylate Openeye Name: ditert-butyl 2-(hydroxymethyl)-2-methyl-6-(2-pyridyl)-1,3-dihydropyridine-4,4-dicarboxylate CAS Name: 2-(hydroxymethyl)-2-methyl-6-(2-pyridinyl)-1,3-dihydropyridine-4,4-dicarboxylic acid ditert-butyl ester IUPAC Name: ditert-butyl 2-(hydroxymethyl)-2-methyl-6-pyridin-2-yl-1,3-dihydropyridine-4,4-dicarboxylate Traditional Name: 2-methyl-2-methylol-6-(2-pyridyl)-1,3-dihydropyridine-4,4-dicarboxylic acid ditert-butyl ester Formula: C22H32N2O5 MolecularWeight: 404.49988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C=C(N1)C2=CC=CC=N2)(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)CO

Isomeric SMILES

CC1(CC(C=C(N1)C2=CC=CC=N2)(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)CO

InChI

InChI=1S/C22H32N2O5/c1-19(2,3)28-17(26)22(18(27)29-20(4,5)6)12-16(15-10-8-9-11-23-15)24-21(7,13-22)14-25/h8-12,24-25H,13-14H2,1-7H3