2,6-dimethyl-5-methylsulfonyl-4-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 2,6-dimethyl-5-methylsulfonyl-4-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 2,6-dimethyl-5-methylsulfonyl-4-(2-pyridyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 2,6-dimethyl-5-methylsulfonyl-4-(2-pyridinyl)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 2,6-dimethyl-5-methylsulfonyl-4-pyridin-2-yl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 5-mesyl-2,6-dimethyl-4-(2-pyridyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)S(=O)(=O)C)C2=CC=CC=N2)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)S(=O)(=O)C)C2=CC=CC=N2)C(=O)O

InChI

InChI=1S/C14H16N2O4S/c1-8-11(14(17)18)12(10-6-4-5-7-15-10)13(9(2)16-8)21(3,19)20/h4-7,12,16H,1-3H3,(H,17,18)