5-methyl-7,10-dihydro-6aH-thiopyrano[1,2-a][1,4]benzothiazin-11-ium-6-one perchlorate

Systemtic Name: 5-methyl-7,10-dihydro-6aH-thiopyrano[1,2-a][1,4]benzothiazin-11-ium-6-one perchlorate Openeye Name: 5-methyl-7,10-dihydro-6aH-thiopyrano[1,2-a][1,4]benzothiazin-11-ium-6-one perchlorate CAS Name: 5-methyl-7,10-dihydro-6aH-thiopyrano[1,2-a][1,4]benzothiazin-11-ium-6-one perchlorate IUPAC Name: 5-methyl-7,10-dihydro-6aH-thiopyrano[1,2-a][1,4]benzothiazin-11-ium-6-one perchlorate Traditional Name: 5-methyl-7,10-dihydro-6aH-thiopyrano[1,2-a][1,4]benzothiazin-11-ium-6-one perchlorate Formula: C13H14ClNO5S MolecularWeight: 331.77196

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2[S+]3CC=CCC3C1=O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CN1C2=CC=CC=C2[S+]3CC=CCC3C1=O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C13H14NOS.ClHO4/c1-14-10-6-2-3-7-11(10)16-9-5-4-8-12(16)13(14)15;2-1(3,4)5/h2-7,12H,8-9H2,1H3;(H,2,3,4,5)/q+1;/p-1