2,3-dihydro-1,3-benzothiazole; 4-methylbenzenesulfonate

Systemtic Name: 2,3-dihydro-1,3-benzothiazole; 4-methylbenzenesulfonate Openeye Name: 2,3-dihydro-1,3-benzothiazole; 4-methylbenzenesulfonate CAS Name: 2,3-dihydro-1,3-benzothiazole; 4-methylbenzenesulfonate IUPAC Name: 2,3-dihydro-1,3-benzothiazole; 4-methylbenzenesulfonate Traditional Name: 2,3-dihydro-1,3-benzothiazole tosylate Formula: C14H14NO3S2- MolecularWeight: 308.39586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1NC2=CC=CC=C2S1

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1NC2=CC=CC=C2S1

InChI

InChI=1S/C7H7NS.C7H8O3S/c1-2-4-7-6(3-1)8-5-9-7;1-6-2-4-7(5-3-6)11(8,9)10/h1-4,8H,5H2;2-5H,1H3,(H,8,9,10)/p-1