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isothiocyanato-(5-nitrofuran-2-yl)methanone

isothiocyanato-(5-nitrofuran-2-yl)methanone

Systemtic Name:isothiocyanato-(5-nitrofuran-2-yl)methanone
Openeye Name:5-nitrofuran-2-carbonyl isothiocyanate
CAS Name:isothiocyanato-(5-nitro-2-furanyl)methanone
IUPAC Name:5-nitrofuran-2-carbonyl isothiocyanate
Traditional Name:isothiocyanato-(5-nitro-2-furyl)methanone
Formula: C6H2N2O4S
MolecularWeight: 198.15608
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C6H2N2O4S/c9-6(7-3-13)4-1-2-5(12-4)8(10)11/h1-2H


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