2-chloranyl-6-(furan-2-ylcarbonylcarbamothioylamino)-4-nitro-phenolate

Systemtic Name: 2-chloranyl-6-(furan-2-ylcarbonylcarbamothioylamino)-4-nitro-phenolate Openeye Name: 2-chloro-6-(furan-2-carbonylcarbamothioylamino)-4-nitro-phenolate CAS Name: 2-chloro-6-[[[[2-furanyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]-4-nitrophenolate IUPAC Name: 2-chloro-6-(furan-2-carbonylcarbamothioylamino)-4-nitrophenolate Traditional Name: 2-chloro-6-(2-furoylthiocarbamoylamino)-4-nitro-phenolate Formula: C12H7ClN3O5S- MolecularWeight: 340.71908

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC(=S)NC2=CC(=CC(=C2[O-])Cl)[N+](=O)[O-]

Isomeric SMILES

C1=COC(=C1)C(=O)NC(=S)NC2=CC(=CC(=C2[O-])Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H8ClN3O5S/c13-7-4-6(16(19)20)5-8(10(7)17)14-12(22)15-11(18)9-2-1-3-21-9/h1-5,17H,(H2,14,15,18,22)/p-1