2-(4-dimethylaminophenyl)-5-[(2-fluoranyl-4-iodanyl-phenyl)amino]pyridine-4-carboxylic acid

Systemtic Name: 2-(4-dimethylaminophenyl)-5-[(2-fluoranyl-4-iodanyl-phenyl)amino]pyridine-4-carboxylic acid Openeye Name: 2-(4-dimethylaminophenyl)-5-(2-fluoro-4-iodo-anilino)pyridine-4-carboxylic acid CAS Name: 2-(4-dimethylaminophenyl)-5-(2-fluoro-4-iodoanilino)-4-pyridinecarboxylic acid IUPAC Name: 2-(4-dimethylaminophenyl)-5-(2-fluoro-4-iodoanilino)pyridine-4-carboxylic acid Traditional Name: 2-(4-dimethylaminophenyl)-5-(2-fluoro-4-iodo-anilino)isonicotinic acid Formula: C20H17FIN3O2 MolecularWeight: 477.270753

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=NC=C(C(=C2)C(=O)O)NC3=C(C=C(C=C3)I)F

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=NC=C(C(=C2)C(=O)O)NC3=C(C=C(C=C3)I)F

InChI

InChI=1S/C20H17FIN3O2/c1-25(2)14-6-3-12(4-7-14)18-10-15(20(26)27)19(11-23-18)24-17-8-5-13(22)9-16(17)21/h3-11,24H,1-2H3,(H,26,27)