2-(acetyloxymethyl)-4-(3-fluorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 2-(acetyloxymethyl)-4-(3-fluorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 2-(acetoxymethyl)-4-(3-fluorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 2-(acetyloxymethyl)-4-(3-fluorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 2-(acetyloxymethyl)-4-(3-fluorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 2-(acetoxymethyl)-4-(3-fluorophenyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C17H16FNO6 MolecularWeight: 349.310443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)COC(=O)C)C(=O)O)C2=CC(=CC=C2)F)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)COC(=O)C)C(=O)O)C2=CC(=CC=C2)F)C(=O)O

InChI

InChI=1S/C17H16FNO6/c1-8-13(16(21)22)14(10-4-3-5-11(18)6-10)15(17(23)24)12(19-8)7-25-9(2)20/h3-6,14,19H,7H2,1-2H3,(H,21,22)(H,23,24)