9-methyl-1,2,3,3a-tetrahydropyrrolo[2,1-b][1,3]benzothiazol-9-ium chloride

Systemtic Name: 9-methyl-1,2,3,3a-tetrahydropyrrolo[2,1-b][1,3]benzothiazol-9-ium chloride Openeye Name: 9-methyl-1,2,3,3a-tetrahydropyrrolo[2,1-b][1,3]benzothiazol-9-ium chloride CAS Name: 9-methyl-1,2,3,3a-tetrahydropyrrolo[2,1-b][1,3]benzothiazol-9-ium chloride IUPAC Name: 9-methyl-1,2,3,3a-tetrahydropyrrolo[2,1-b][1,3]benzothiazol-9-ium chloride Traditional Name: 9-methyl-1,2,3,3a-tetrahydropyrrolo[2,1-b][1,3]benzothiazol-9-ium chloride Formula: C11H14ClNS MolecularWeight: 227.75356

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]12CCCC1SC3=CC=CC=C23.[Cl-]

Isomeric SMILES

C[N+]12CCCC1SC3=CC=CC=C23.[Cl-]

InChI

InChI=1S/C11H14NS.ClH/c1-12-8-4-7-11(12)13-10-6-3-2-5-9(10)12;/h2-3,5-6,11H,4,7-8H2,1H3;1H/q+1;/p-1