(2-azanyl-1,3-benzothiazol-6-yl) benzenesulfonate

Systemtic Name: (2-azanyl-1,3-benzothiazol-6-yl) benzenesulfonate Openeye Name: (2-amino-1,3-benzothiazol-6-yl) benzenesulfonate CAS Name: benzenesulfonic acid (2-amino-1,3-benzothiazol-6-yl) ester IUPAC Name: (2-amino-1,3-benzothiazol-6-yl) benzenesulfonate Traditional Name: benzenesulfonic acid (2-amino-1,3-benzothiazol-6-yl) ester Formula: C13H10N2O3S2 MolecularWeight: 306.3601

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)N=C(S3)N

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)OC2=CC3=C(C=C2)N=C(S3)N

InChI

InChI=1S/C13H10N2O3S2/c14-13-15-11-7-6-9(8-12(11)19-13)18-20(16,17)10-4-2-1-3-5-10/h1-8H,(H2,14,15)