4-[4-({[4-chloro-3-(trifluoromethyl)phenyl]carbamoyl}amino)phenoxy]-2-(methylcarbamoyl)pyridin-1-ium-1-olate

CAS: 583840-03-3

Formula: C21H16ClF3N4O4

SMILES: CNC(=O)C1=[N+]([O-])C=CC(OC2=CC=C(NC(=O)NC3=CC(=C(Cl)C=C3)C(F)(F)F)C=C2)=C1

IUPAC: 4-[4-({[4-chloro-3-(trifluoromethyl)phenyl]carbamoyl}amino)phenoxy]-2-(methylcarbamoyl)pyridin-1-ium-1-olate

InChI: InChI=1S/C21H16ClF3N4O4/c1-26-19(30)18-11-15(8-9-29(18)32)33-14-5-2-12(3-6-14)27-20(31)28-13-4-7-17(22)16(10-13)21(23,24)25/h2-11H,1H3,(H,26,30)(H2,27,28,31)

Composition: C (52.46%), H (3.35%), Cl (7.37%), F (11.85%), N (11.65%), O (13.31%)

Molar Mass: 480.83

Atom Count: 49

Heavy Atom Count: 33