[(E)-1-(benzotriazol-1-yl)-4,4-dimethyl-pent-1-en-2-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [(E)-1-(benzotriazol-1-yl)-4,4-dimethyl-pent-1-en-2-yl] tris(fluoranyl)methanesulfonate Openeye Name: [(1E)-1-(benzotriazol-1-ylmethylene)-3,3-dimethyl-butyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [(E)-1-(1-benzotriazolyl)-4,4-dimethylpent-1-en-2-yl] ester IUPAC Name: [(E)-1-(benzotriazol-1-yl)-4,4-dimethylpent-1-en-2-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [(E)-2-(benzotriazol-1-yl)-1-neopentyl-vinyl] ester Formula: C14H16F3N3O3S MolecularWeight: 363.35535

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=CN1C2=CC=CC=C2N=N1)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC(C)(C)C/C(=C\N1C2=CC=CC=C2N=N1)/OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C14H16F3N3O3S/c1-13(2,3)8-10(23-24(21,22)14(15,16)17)9-20-12-7-5-4-6-11(12)18-19-20/h4-7,9H,8H2,1-3H3/b10-9+