11b-phenyl-5,7-dihydro-[2]benzothiolo[1,2-a][2]benzothiol-6-ium perchlorate

Systemtic Name: 11b-phenyl-5,7-dihydro-[2]benzothiolo[1,2-a][2]benzothiol-6-ium perchlorate Openeye Name: 11b-phenyl-5,7-dihydro-[2]benzothiolo[1,2-a][2]benzothiol-6-ium perchlorate CAS Name: 11b-phenyl-5,7-dihydro-[2]benzothiolo[1,2-a][2]benzothiol-6-ium perchlorate IUPAC Name: 11b-phenyl-5,7-dihydro-[2]benzothiolo[1,2-a][2]benzothiol-6-ium perchlorate Traditional Name: 11b-phenyl-5,7-dihydroisobenzothiophen[1,2-a]isobenzothiophen-6-ium perchlorate Formula: C21H17ClO4S MolecularWeight: 400.87528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C3([S+]1CC4=CC=CC=C43)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1C2=CC=CC=C2C3([S+]1CC4=CC=CC=C43)C5=CC=CC=C5.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C21H17S.ClHO4/c1-2-10-18(11-3-1)21-19-12-6-4-8-16(19)14-22(21)15-17-9-5-7-13-20(17)21;2-1(3,4)5/h1-13H,14-15H2;(H,2,3,4,5)/q+1;/p-1