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

Systemtic Name: 4-(2-fluoranyl-3-imidazol-1-yl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 4-(2-fluoro-3-imidazol-1-yl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 4-[2-fluoro-3-(1-imidazolyl)phenyl]-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 4-(2-fluoro-3-imidazol-1-ylphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-(2-fluoro-3-imidazol-1-yl-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C18H16FN3O4 MolecularWeight: 357.335743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)O)C2=C(C(=CC=C2)N3C=CN=C3)F)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)O)C2=C(C(=CC=C2)N3C=CN=C3)F)C(=O)O

InChI

InChI=1S/C18H16FN3O4/c1-9-13(17(23)24)15(14(18(25)26)10(2)21-9)11-4-3-5-12(16(11)19)22-7-6-20-8-22/h3-8,15,21H,1-2H3,(H,23,24)(H,25,26)