[(Z)-1-(benzotriazol-1-yl)-4-phenyl-but-1-en-2-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [(Z)-1-(benzotriazol-1-yl)-4-phenyl-but-1-en-2-yl] tris(fluoranyl)methanesulfonate Openeye Name: [(1Z)-1-(benzotriazol-1-ylmethylene)-3-phenyl-propyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [(Z)-1-(1-benzotriazolyl)-4-phenylbut-1-en-2-yl] ester IUPAC Name: [(Z)-1-(benzotriazol-1-yl)-4-phenylbut-1-en-2-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [(Z)-2-(benzotriazol-1-yl)-1-phenethyl-vinyl] ester Formula: C17H14F3N3O3S MolecularWeight: 397.37157

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=CN2C3=CC=CC=C3N=N2)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CC/C(=C/N2C3=CC=CC=C3N=N2)/OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C17H14F3N3O3S/c18-17(19,20)27(24,25)26-14(11-10-13-6-2-1-3-7-13)12-23-16-9-5-4-8-15(16)21-22-23/h1-9,12H,10-11H2/b14-12-