N-butyl-2-[6-[2-chloranyl-6-fluoranyl-4-(trifluoromethyl)phenoxy]benzotriazol-1-yl]propanamide

Systemtic Name: N-butyl-2-[6-[2-chloranyl-6-fluoranyl-4-(trifluoromethyl)phenoxy]benzotriazol-1-yl]propanamide Openeye Name: N-butyl-2-[6-[2-chloro-6-fluoro-4-(trifluoromethyl)phenoxy]benzotriazol-1-yl]propanamide CAS Name: N-butyl-2-[6-[2-chloro-6-fluoro-4-(trifluoromethyl)phenoxy]-1-benzotriazolyl]propanamide IUPAC Name: N-butyl-2-[6-[2-chloro-6-fluoro-4-(trifluoromethyl)phenoxy]benzotriazol-1-yl]propanamide Traditional Name: N-butyl-2-[6-[2-chloro-6-fluoro-4-(trifluoromethyl)phenoxy]benzotriazol-1-yl]propionamide Formula: C20H19ClF4N4O2 MolecularWeight: 458.837073

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C)N1C2=C(C=CC(=C2)OC3=C(C=C(C=C3Cl)C(F)(F)F)F)N=N1

Isomeric SMILES

CCCCNC(=O)C(C)N1C2=C(C=CC(=C2)OC3=C(C=C(C=C3Cl)C(F)(F)F)F)N=N1

InChI

InChI=1S/C20H19ClF4N4O2/c1-3-4-7-26-19(30)11(2)29-17-10-13(5-6-16(17)27-28-29)31-18-14(21)8-12(9-15(18)22)20(23,24)25/h5-6,8-11H,3-4,7H2,1-2H3,(H,26,30)