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5-isothiocyanato-1,3-benzodioxole

5-isothiocyanato-1,3-benzodioxole

Systemtic Name:5-isothiocyanato-1,3-benzodioxole
Openeye Name:5-isothiocyanato-1,3-benzodioxole
CAS Name:5-isothiocyanato-1,3-benzodioxole
IUPAC Name:5-isothiocyanato-1,3-benzodioxole
Traditional Name:5-isothiocyanato-1,3-benzodioxole
Formula: C8H5NO2S
MolecularWeight: 179.1958
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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)N=C=S


Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)N=C=S


InChI

InChI=1S/C8H5NO2S/c12-4-9-6-1-2-7-8(3-6)11-5-10-7/h1-3H,5H2


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