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

Systemtic Name: 4-(2,3-dimethoxyphenyl)-2-(fluoranylmethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 4-(2,3-dimethoxyphenyl)-2-(fluoromethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 4-(2,3-dimethoxyphenyl)-2-(fluoromethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 4-(2,3-dimethoxyphenyl)-2-(fluoromethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-(2,3-dimethoxyphenyl)-2-(fluoromethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C17H18FNO6 MolecularWeight: 351.326323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)CF)C(=O)O)C2=C(C(=CC=C2)OC)OC)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)CF)C(=O)O)C2=C(C(=CC=C2)OC)OC)C(=O)O

InChI

InChI=1S/C17H18FNO6/c1-8-12(16(20)21)13(14(17(22)23)10(7-18)19-8)9-5-4-6-11(24-2)15(9)25-3/h4-6,13,19H,7H2,1-3H3,(H,20,21)(H,22,23)