2-(fluoranylmethyl)-6-methyl-4-(2-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 2-(fluoranylmethyl)-6-methyl-4-(2-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 2-(fluoromethyl)-6-methyl-4-(o-tolyl)-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 2-(fluoromethyl)-6-methyl-4-(2-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 2-(fluoromethyl)-6-methyl-4-(2-methylphenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 2-(fluoromethyl)-6-methyl-4-(o-tolyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C16H16FNO4 MolecularWeight: 305.300943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C(=C(NC(=C2C(=O)O)CF)C)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2C(=C(NC(=C2C(=O)O)CF)C)C(=O)O

InChI

InChI=1S/C16H16FNO4/c1-8-5-3-4-6-10(8)13-12(15(19)20)9(2)18-11(7-17)14(13)16(21)22/h3-6,13,18H,7H2,1-2H3,(H,19,20)(H,21,22)