N-[1-(5-chloranylbenzotriazol-1-yl)-2-cyano-propan-2-yl]-4-(trifluoromethyloxy)benzamide

Systemtic Name: N-[1-(5-chloranylbenzotriazol-1-yl)-2-cyano-propan-2-yl]-4-(trifluoromethyloxy)benzamide Openeye Name: N-[2-(5-chlorobenzotriazol-1-yl)-1-cyano-1-methyl-ethyl]-4-(trifluoromethoxy)benzamide CAS Name: N-[1-(5-chloro-1-benzotriazolyl)-2-cyanopropan-2-yl]-4-(trifluoromethoxy)benzamide IUPAC Name: N-[1-(5-chlorobenzotriazol-1-yl)-2-cyanopropan-2-yl]-4-(trifluoromethoxy)benzamide Traditional Name: N-[2-(5-chlorobenzotriazol-1-yl)-1-cyano-1-methyl-ethyl]-4-(trifluoromethoxy)benzamide Formula: C18H13ClF3N5O2 MolecularWeight: 423.77633

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C2=C(C=C(C=C2)Cl)N=N1)(C#N)NC(=O)C3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CC(CN1C2=C(C=C(C=C2)Cl)N=N1)(C#N)NC(=O)C3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C18H13ClF3N5O2/c1-17(9-23,10-27-15-7-4-12(19)8-14(15)25-26-27)24-16(28)11-2-5-13(6-3-11)29-18(20,21)22/h2-8H,10H2,1H3,(H,24,28)