2-(2-hydroxyethylamino)-1,4-dimethyl-benzo[e][1,3]benzothiazol-1-ium-5-ol chloride

Systemtic Name: 2-(2-hydroxyethylamino)-1,4-dimethyl-benzo[e][1,3]benzothiazol-1-ium-5-ol chloride Openeye Name: 2-(2-hydroxyethylamino)-1,4-dimethyl-benzo[e][1,3]benzothiazol-1-ium-5-ol chloride CAS Name: 2-(2-hydroxyethylamino)-1,4-dimethyl-5-benzo[e][1,3]benzothiazol-1-iumol chloride IUPAC Name: 2-(2-hydroxyethylamino)-1,4-dimethylbenzo[e][1,3]benzothiazol-1-ium-5-ol chloride Traditional Name: 2-(2-hydroxyethylamino)-1,4-dimethyl-benzo[e][1,3]benzothiazol-1-ium-5-ol chloride Formula: C15H17ClN2O2S MolecularWeight: 324.82568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N2O2S.ClH/c1-9-13(19)11-6-4-3-5-10(11)12-14(9)20-15(17(12)2)16-7-8-18;/h3-6,18-19H,7-8H2,1-2H3;1H