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2-ethyl-3H-1,3-benzothiazole-2-sulfonate

2-ethyl-3H-1,3-benzothiazole-2-sulfonate

Systemtic Name:2-ethyl-3H-1,3-benzothiazole-2-sulfonate
Openeye Name:2-ethyl-3H-1,3-benzothiazole-2-sulfonate
CAS Name:2-ethyl-3H-1,3-benzothiazole-2-sulfonate
IUPAC Name:2-ethyl-3H-1,3-benzothiazole-2-sulfonate
Traditional Name:2-ethyl-3H-1,3-benzothiazole-2-sulfonate
Formula: C9H10NO3S2-
MolecularWeight: 244.3106
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Descriptors Computed from Structure

Canonical SMILES:

CCC1(NC2=CC=CC=C2S1)S(=O)(=O)[O-]


Isomeric SMILES

CCC1(NC2=CC=CC=C2S1)S(=O)(=O)[O-]


InChI

InChI=1S/C9H11NO3S2/c1-2-9(15(11,12)13)10-7-5-3-4-6-8(7)14-9/h3-6,10H,2H2,1H3,(H,11,12,13)/p-1


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