2-(4-methoxyphenyl)-4-methylsulfanyl-chromenylium perchlorate

Systemtic Name: 2-(4-methoxyphenyl)-4-methylsulfanyl-chromenylium perchlorate Openeye Name: 2-(4-methoxyphenyl)-4-methylsulfanyl-chromenylium perchlorate CAS Name: 2-(4-methoxyphenyl)-4-(methylthio)-1-benzopyrylium perchlorate IUPAC Name: 2-(4-methoxyphenyl)-4-methylsulfanylchromenylium perchlorate Traditional Name: 2-(4-methoxyphenyl)-4-(methylthio)-1-benzopyrylium perchlorate Formula: C17H15ClO6S MolecularWeight: 382.8154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=[O+]C3=CC=CC=C3C(=C2)SC.[O-]Cl(=O)(=O)=O

Isomeric SMILES

COC1=CC=C(C=C1)C2=[O+]C3=CC=CC=C3C(=C2)SC.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C17H15O2S.ClHO4/c1-18-13-9-7-12(8-10-13)16-11-17(20-2)14-5-3-4-6-15(14)19-16;2-1(3,4)5/h3-11H,1-2H3;(H,2,3,4,5)/q+1;/p-1