2-(furan-2-ylmethylcarbamoyl)-4-nitro-benzoic acid

Systemtic Name: 2-(furan-2-ylmethylcarbamoyl)-4-nitro-benzoic acid Openeye Name: 2-(2-furylmethylcarbamoyl)-4-nitro-benzoic acid CAS Name: 2-[(2-furanylmethylamino)-oxomethyl]-4-nitrobenzoic acid IUPAC Name: 2-(furan-2-ylmethylcarbamoyl)-4-nitrobenzoic acid Traditional Name: 2-(2-furfurylcarbamoyl)-4-nitro-benzoic acid Formula: C13H10N2O6 MolecularWeight: 290.2283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N2O6/c16-12(14-7-9-2-1-5-21-9)11-6-8(15(19)20)3-4-10(11)13(17)18/h1-6H,7H2,(H,14,16)(H,17,18)