2-[[2-fluoranyl-4-(3-methoxyphenyl)-5-methyl-phenyl]amino]-5-methyl-pyridine-3-carboxylic acid

Systemtic Name: 2-[[2-fluoranyl-4-(3-methoxyphenyl)-5-methyl-phenyl]amino]-5-methyl-pyridine-3-carboxylic acid Openeye Name: 2-[2-fluoro-4-(3-methoxyphenyl)-5-methyl-anilino]-5-methyl-pyridine-3-carboxylic acid CAS Name: 2-[2-fluoro-4-(3-methoxyphenyl)-5-methylanilino]-5-methyl-3-pyridinecarboxylic acid IUPAC Name: 2-[2-fluoro-4-(3-methoxyphenyl)-5-methylanilino]-5-methylpyridine-3-carboxylic acid Traditional Name: 2-[2-fluoro-4-(3-methoxyphenyl)-5-methyl-anilino]-5-methyl-nicotinic acid Formula: C21H19FN2O3 MolecularWeight: 366.385563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=CC(=CC=C2)OC)F)NC3=NC=C(C=C3C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C=C1C2=CC(=CC=C2)OC)F)NC3=NC=C(C=C3C(=O)O)C

InChI

InChI=1S/C21H19FN2O3/c1-12-7-17(21(25)26)20(23-11-12)24-19-8-13(2)16(10-18(19)22)14-5-4-6-15(9-14)27-3/h4-11H,1-3H3,(H,23,24)(H,25,26)