2-azanyl-4-methyl-benzo[e][1,3]benzothiazol-1-ium-5-ol chloride

Systemtic Name: 2-azanyl-4-methyl-benzo[e][1,3]benzothiazol-1-ium-5-ol chloride Openeye Name: 2-amino-4-methyl-benzo[e][1,3]benzothiazol-1-ium-5-ol chloride CAS Name: 2-amino-4-methyl-5-benzo[e][1,3]benzothiazol-1-iumol chloride IUPAC Name: 2-amino-4-methylbenzo[e][1,3]benzothiazol-1-ium-5-ol chloride Traditional Name: 2-amino-4-methyl-benzo[e][1,3]benzothiazol-1-ium-5-ol chloride Formula: C12H11ClN2OS MolecularWeight: 266.74654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C3=C1SC(=[NH+]3)N)O.[Cl-]

Isomeric SMILES

CC1=C(C2=CC=CC=C2C3=C1SC(=[NH+]3)N)O.[Cl-]

InChI

InChI=1S/C12H10N2OS.ClH/c1-6-10(15)8-5-3-2-4-7(8)9-11(6)16-12(13)14-9;/h2-5,15H,1H3,(H2,13,14);1H