6-(1-oxidanylpentyl)-3H-1,3-benzothiazol-2-one

Systemtic Name: 6-(1-oxidanylpentyl)-3H-1,3-benzothiazol-2-one Openeye Name: 6-(1-hydroxypentyl)-3H-1,3-benzothiazol-2-one CAS Name: 6-(1-hydroxypentyl)-3H-1,3-benzothiazol-2-one IUPAC Name: 6-(1-hydroxypentyl)-3H-1,3-benzothiazol-2-one Traditional Name: 6-(1-hydroxypentyl)-3H-1,3-benzothiazol-2-one Formula: C12H15NO2S MolecularWeight: 237.318

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC2=C(C=C1)NC(=O)S2)O

Isomeric SMILES

CCCCC(C1=CC2=C(C=C1)NC(=O)S2)O

InChI

InChI=1S/C12H15NO2S/c1-2-3-4-10(14)8-5-6-9-11(7-8)16-12(15)13-9/h5-7,10,14H,2-4H2,1H3,(H,13,15)