[(4-dimethylsulfoniophenyl)-(2-methylphenyl)methyl] carbonate perchlorate

Systemtic Name: [(4-dimethylsulfoniophenyl)-(2-methylphenyl)methyl] carbonate perchlorate Openeye Name: [(4-dimethylsulfoniophenyl)-(o-tolyl)methyl] carbonate perchlorate CAS Name: [(4-dimethylsulfoniophenyl)-(2-methylphenyl)methyl] carbonate perchlorate IUPAC Name: [(4-dimethylsulfoniophenyl)-(2-methylphenyl)methyl] carbonate perchlorate Traditional Name: [(4-dimethylsulfoniophenyl)-(o-tolyl)methyl] carbonate perchlorate Formula: C17H18ClO7S- MolecularWeight: 401.83862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18O3S.ClHO4/c1-12-6-4-5-7-15(12)16(20-17(18)19)13-8-10-14(11-9-13)21(2)3;2-1(3,4)5/h4-11,16H,1-3H3;(H,2,3,4,5)/p-1