2-(furan-3-ylcarbonylamino)-5-nitro-benzoic acid

Systemtic Name: 2-(furan-3-ylcarbonylamino)-5-nitro-benzoic acid Openeye Name: 2-(furan-3-carbonylamino)-5-nitro-benzoic acid CAS Name: 2-[[3-furanyl(oxo)methyl]amino]-5-nitrobenzoic acid IUPAC Name: 2-(furan-3-carbonylamino)-5-nitrobenzoic acid Traditional Name: 2-(3-furoylamino)-5-nitro-benzoic acid Formula: C12H8N2O6 MolecularWeight: 276.20172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8N2O6/c15-11(7-3-4-20-6-7)13-10-2-1-8(14(18)19)5-9(10)12(16)17/h1-6H,(H,13,15)(H,16,17)