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

Systemtic Name: 4-(3-fluoranyl-4-methoxy-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 4-(3-fluoro-4-methoxy-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 4-(3-fluoro-4-methoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 4-(3-fluoro-4-methoxyphenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-(3-fluoro-4-methoxy-phenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C16H16FNO5 MolecularWeight: 321.300343

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16FNO5/c1-7-12(15(19)20)14(13(16(21)22)8(2)18-7)9-4-5-11(23-3)10(17)6-9/h4-6,14,18H,1-3H3,(H,19,20)(H,21,22)