methyl 1,3-dimethylpyrido[2,1-b][1,3]benzothiazol-10-ium-7-carboxylate

Systemtic Name: methyl 1,3-dimethylpyrido[2,1-b][1,3]benzothiazol-10-ium-7-carboxylate Openeye Name: methyl 1,3-dimethylpyrido[2,1-b][1,3]benzothiazol-10-ium-7-carboxylate CAS Name: 1,3-dimethyl-7-pyrido[2,1-b][1,3]benzothiazol-10-iumcarboxylic acid methyl ester IUPAC Name: methyl 1,3-dimethylpyrido[2,1-b][1,3]benzothiazol-10-ium-7-carboxylate Traditional Name: 1,3-dimethylpyrido[2,1-b][1,3]benzothiazol-10-ium-7-carboxylic acid methyl ester Formula: C15H14NO2S+ MolecularWeight: 272.34216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+]2C3=C(C=C(C=C3)C(=O)OC)SC2=C1)C

Isomeric SMILES

CC1=CC(=[N+]2C3=C(C=C(C=C3)C(=O)OC)SC2=C1)C

InChI

InChI=1S/C15H14NO2S/c1-9-6-10(2)16-12-5-4-11(15(17)18-3)8-13(12)19-14(16)7-9/h4-8H,1-3H3/q+1