2-azanyl-5-ethylsulfonyl-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 2-azanyl-5-ethylsulfonyl-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 2-amino-5-ethylsulfonyl-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid CAS Name: 2-amino-5-ethylsulfonyl-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 2-amino-5-ethylsulfonyl-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 2-amino-5-esyl-6-methyl-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3-carboxylic acid Formula: C16H17F3N2O4S MolecularWeight: 390.37739

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=C(NC(=C(C1C2=CC=CC=C2C(F)(F)F)C(=O)O)N)C

Isomeric SMILES

CCS(=O)(=O)C1=C(NC(=C(C1C2=CC=CC=C2C(F)(F)F)C(=O)O)N)C

InChI

InChI=1S/C16H17F3N2O4S/c1-3-26(24,25)13-8(2)21-14(20)12(15(22)23)11(13)9-6-4-5-7-10(9)16(17,18)19/h4-7,11,21H,3,20H2,1-2H3,(H,22,23)