phenyl 2-[[2-(3-methoxyphenyl)ethanoyldiazenyl]methyl]-4-(trifluoromethyl)benzenesulfonate

Systemtic Name: phenyl 2-[[2-(3-methoxyphenyl)ethanoyldiazenyl]methyl]-4-(trifluoromethyl)benzenesulfonate Openeye Name: phenyl 2-[[2-(3-methoxyphenyl)acetyl]azomethyl]-4-(trifluoromethyl)benzenesulfonate CAS Name: 2-[[2-(3-methoxyphenyl)-1-oxoethyl]azomethyl]-4-(trifluoromethyl)benzenesulfonic acid phenyl ester IUPAC Name: phenyl 2-[[[2-(3-methoxyphenyl)acetyl]diazenyl]methyl]-4-(trifluoromethyl)benzenesulfonate Traditional Name: 2-[[2-(3-methoxyphenyl)acetyl]azomethyl]-4-(trifluoromethyl)benzenesulfonic acid phenyl ester Formula: C23H19F3N2O5S MolecularWeight: 492.46757

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC(=O)N=NCC2=C(C=CC(=C2)C(F)(F)F)S(=O)(=O)OC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)CC(=O)N=NCC2=C(C=CC(=C2)C(F)(F)F)S(=O)(=O)OC3=CC=CC=C3

InChI

InChI=1S/C23H19F3N2O5S/c1-32-20-9-5-6-16(12-20)13-22(29)28-27-15-17-14-18(23(24,25)26)10-11-21(17)34(30,31)33-19-7-3-2-4-8-19/h2-12,14H,13,15H2,1H3