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1,3-benzodioxol-4-yl thiocyanate

1,3-benzodioxol-4-yl thiocyanate

Systemtic Name:1,3-benzodioxol-4-yl thiocyanate
Openeye Name:1,3-benzodioxol-4-yl thiocyanate
CAS Name:thiocyanic acid 1,3-benzodioxol-4-yl ester
IUPAC Name:1,3-benzodioxol-4-yl thiocyanate
Traditional Name:thiocyanic acid 1,3-benzodioxol-4-yl ester
Formula: C8H5NO2S
MolecularWeight: 179.1958
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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC=C2)SC#N


Isomeric SMILES

C1OC2=C(O1)C(=CC=C2)SC#N


InChI

InChI=1S/C8H5NO2S/c9-4-12-7-3-1-2-6-8(7)11-5-10-6/h1-3H,5H2


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