5-ethylsulfonyl-2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 5-ethylsulfonyl-2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 5-ethylsulfonyl-2,6-dimethyl-4-(p-tolyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 5-ethylsulfonyl-2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 5-ethylsulfonyl-2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 5-esyl-2,6-dimethyl-4-(p-tolyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C17H21NO4S MolecularWeight: 335.41794

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=C(NC(=C(C1C2=CC=C(C=C2)C)C(=O)O)C)C

Isomeric SMILES

CCS(=O)(=O)C1=C(NC(=C(C1C2=CC=C(C=C2)C)C(=O)O)C)C

InChI

InChI=1S/C17H21NO4S/c1-5-23(21,22)16-12(4)18-11(3)14(17(19)20)15(16)13-8-6-10(2)7-9-13/h6-9,15,18H,5H2,1-4H3,(H,19,20)