2-[(4-methoxyphenyl)amino]-4-methyl-benzo[e][1,3]benzothiazol-1-ium-5-ol chloride

Systemtic Name: 2-[(4-methoxyphenyl)amino]-4-methyl-benzo[e][1,3]benzothiazol-1-ium-5-ol chloride Openeye Name: 2-(4-methoxyanilino)-4-methyl-benzo[e][1,3]benzothiazol-1-ium-5-ol chloride CAS Name: 2-(4-methoxyanilino)-4-methyl-5-benzo[e][1,3]benzothiazol-1-iumol chloride IUPAC Name: 2-(4-methoxyanilino)-4-methylbenzo[e][1,3]benzothiazol-1-ium-5-ol chloride Traditional Name: 4-methyl-2-(p-anisidino)benzo[e][1,3]benzothiazol-1-ium-5-ol chloride Formula: C19H17ClN2O2S MolecularWeight: 372.86848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C3=C1SC(=[NH+]3)NC4=CC=C(C=C4)OC)O.[Cl-]

Isomeric SMILES

CC1=C(C2=CC=CC=C2C3=C1SC(=[NH+]3)NC4=CC=C(C=C4)OC)O.[Cl-]

InChI

InChI=1S/C19H16N2O2S.ClH/c1-11-17(22)15-6-4-3-5-14(15)16-18(11)24-19(21-16)20-12-7-9-13(23-2)10-8-12;/h3-10,22H,1-2H3,(H,20,21);1H