N-[3-cyano-4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]-2H-benzotriazole-5-carboxamide

Systemtic Name: N-[3-cyano-4-[2,2,2-tris(fluoranyl)ethoxy]phenyl]-2H-benzotriazole-5-carboxamide Openeye Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-2H-benzotriazole-5-carboxamide CAS Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-2H-benzotriazole-5-carboxamide IUPAC Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-2H-benzotriazole-5-carboxamide Traditional Name: N-[3-cyano-4-(2,2,2-trifluoroethoxy)phenyl]-2H-benzotriazole-5-carboxamide Formula: C16H10F3N5O2 MolecularWeight: 361.27811

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NNN=C2C=C1C(=O)NC3=CC(=C(C=C3)OCC(F)(F)F)C#N

Isomeric SMILES

C1=CC2=NNN=C2C=C1C(=O)NC3=CC(=C(C=C3)OCC(F)(F)F)C#N

InChI

InChI=1S/C16H10F3N5O2/c17-16(18,19)8-26-14-4-2-11(5-10(14)7-20)21-15(25)9-1-3-12-13(6-9)23-24-22-12/h1-6H,8H2,(H,21,25)(H,22,23,24)