5-(furan-2-ylmethylamino)-2-nitro-benzoate

Systemtic Name: 5-(furan-2-ylmethylamino)-2-nitro-benzoate Openeye Name: 5-(2-furylmethylamino)-2-nitro-benzoate CAS Name: 5-(2-furanylmethylamino)-2-nitrobenzoate IUPAC Name: 5-(furan-2-ylmethylamino)-2-nitrobenzoate Traditional Name: 5-(2-furfurylamino)-2-nitro-benzoate Formula: C12H9N2O5- MolecularWeight: 261.21026

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=COC(=C1)CNC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C12H10N2O5/c15-12(16)10-6-8(3-4-11(10)14(17)18)13-7-9-2-1-5-19-9/h1-6,13H,7H2,(H,15,16)/p-1