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1-(isothiocyanatomethyl)-3-nitro-benzene

1-(isothiocyanatomethyl)-3-nitro-benzene

Systemtic Name:1-(isothiocyanatomethyl)-3-nitro-benzene
Openeye Name:1-(isothiocyanatomethyl)-3-nitro-benzene
CAS Name:1-(isothiocyanatomethyl)-3-nitrobenzene
IUPAC Name:1-(isothiocyanatomethyl)-3-nitrobenzene
Traditional Name:1-(isothiocyanatomethyl)-3-nitro-benzene
Formula: C8H6N2O2S
MolecularWeight: 194.21044
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CN=C=S


Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CN=C=S


InChI

InChI=1S/C8H6N2O2S/c11-10(12)8-3-1-2-7(4-8)5-9-6-13/h1-4H,5H2


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