3-methyl-2H-1,4-benzothiazin-4-ium bromide

Systemtic Name: 3-methyl-2H-1,4-benzothiazin-4-ium bromide Openeye Name: 3-methyl-2H-1,4-benzothiazin-4-ium bromide CAS Name: 3-methyl-2H-1,4-benzothiazin-4-ium bromide IUPAC Name: 3-methyl-2H-1,4-benzothiazin-4-ium bromide Traditional Name: 3-methyl-2H-1,4-benzothiazin-4-ium bromide Formula: C9H10BrNS MolecularWeight: 244.1514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C2=CC=CC=C2SC1.[Br-]

Isomeric SMILES

CC1=[NH+]C2=CC=CC=C2SC1.[Br-]

InChI

InChI=1S/C9H9NS.BrH/c1-7-6-11-9-5-3-2-4-8(9)10-7;/h2-5H,6H2,1H3;1H