2-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl-[3,3,3-tris(fluoranyl)propyl]amino]pyridine-3-carboxylic acid

Systemtic Name: 2-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl-[3,3,3-tris(fluoranyl)propyl]amino]pyridine-3-carboxylic acid Openeye Name: 2-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl-(3,3,3-trifluoropropyl)amino]pyridine-3-carboxylic acid CAS Name: 2-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl-(3,3,3-trifluoropropyl)amino]-3-pyridinecarboxylic acid IUPAC Name: 2-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl-(3,3,3-trifluoropropyl)amino]pyridine-3-carboxylic acid Traditional Name: 2-[[4-[2-(2H-tetrazol-5-yl)phenyl]benzyl]-(3,3,3-trifluoropropyl)amino]nicotinic acid Formula: C23H19F3N6O2 MolecularWeight: 468.43117

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(C=C2)CN(CCC(F)(F)F)C3=C(C=CC=N3)C(=O)O)C4=NNN=N4

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(C=C2)CN(CCC(F)(F)F)C3=C(C=CC=N3)C(=O)O)C4=NNN=N4

InChI

InChI=1S/C23H19F3N6O2/c24-23(25,26)11-13-32(21-19(22(33)34)6-3-12-27-21)14-15-7-9-16(10-8-15)17-4-1-2-5-18(17)20-28-30-31-29-20/h1-10,12H,11,13-14H2,(H,33,34)(H,28,29,30,31)