2-[6-(2-chlorophenyl)-8-(trifluoromethyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethanol

Systemtic Name: 2-[6-(2-chlorophenyl)-8-(trifluoromethyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethanol Openeye Name: 2-[6-(2-chlorophenyl)-8-(trifluoromethyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethanol CAS Name: 2-[6-(2-chlorophenyl)-8-(trifluoromethyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethanol IUPAC Name: 2-[6-(2-chlorophenyl)-8-(trifluoromethyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethanol Traditional Name: 2-[6-(2-chlorophenyl)-8-(trifluoromethyl)-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-1-yl]ethanol Formula: C19H14ClF3N4O MolecularWeight: 406.78887

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=NN=C(N2C3=C(C=C(C=C3)C(F)(F)F)C(=N1)C4=CC=CC=C4Cl)CCO

Isomeric SMILES

C1C2=NN=C(N2C3=C(C=C(C=C3)C(F)(F)F)C(=N1)C4=CC=CC=C4Cl)CCO

InChI

InChI=1S/C19H14ClF3N4O/c20-14-4-2-1-3-12(14)18-13-9-11(19(21,22)23)5-6-15(13)27-16(7-8-28)25-26-17(27)10-24-18/h1-6,9,28H,7-8,10H2