4-(2-chloranyl-6-fluoranyl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 4-(2-chloranyl-6-fluoranyl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 4-(2-chloro-6-fluoro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 4-(2-chloro-6-fluorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 4-(2-chloro-6-fluorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-(2-chloro-6-fluoro-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C15H13ClFNO4 MolecularWeight: 325.719423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)O)C2=C(C=CC=C2Cl)F)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)O)C2=C(C=CC=C2Cl)F)C(=O)O

InChI

InChI=1S/C15H13ClFNO4/c1-6-10(14(19)20)13(11(15(21)22)7(2)18-6)12-8(16)4-3-5-9(12)17/h3-5,13,18H,1-2H3,(H,19,20)(H,21,22)