dimethyl-[2,4,5-trimethyl-3-(phenylcarbamoyloxy)phenyl]sulfanium; methyl sulfate

Systemtic Name: dimethyl-[2,4,5-trimethyl-3-(phenylcarbamoyloxy)phenyl]sulfanium; methyl sulfate Openeye Name: dimethyl-[2,4,5-trimethyl-3-(phenylcarbamoyloxy)phenyl]sulfonium; methyl sulfate CAS Name: [3-[anilino(oxo)methoxy]-2,4,5-trimethylphenyl]-dimethylsulfonium; methyl sulfate IUPAC Name: dimethyl-[2,4,5-trimethyl-3-(phenylcarbamoyloxy)phenyl]sulfanium; methyl sulfate Traditional Name: dimethyl-[2,4,5-trimethyl-3-(phenylcarbamoyloxy)phenyl]sulfonium; methyl sulfate Formula: C19H25NO6S2 MolecularWeight: 427.5349

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)OC(=O)NC2=CC=CC=C2)C)[S+](C)C.COS(=O)(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1C)OC(=O)NC2=CC=CC=C2)C)[S+](C)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C18H21NO2S.CH4O4S/c1-12-11-16(22(4)5)14(3)17(13(12)2)21-18(20)19-15-9-7-6-8-10-15;1-5-6(2,3)4/h6-11H,1-5H3;1H3,(H,2,3,4)