N-(furan-2-ylmethyl)-2,4-dinitro-benzamide

Systemtic Name: N-(furan-2-ylmethyl)-2,4-dinitro-benzamide Openeye Name: N-(2-furylmethyl)-2,4-dinitro-benzamide CAS Name: N-(2-furanylmethyl)-2,4-dinitrobenzamide IUPAC Name: N-(furan-2-ylmethyl)-2,4-dinitrobenzamide Traditional Name: N-(2-furfuryl)-2,4-dinitro-benzamide Formula: C12H9N3O6 MolecularWeight: 291.21636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H9N3O6/c16-12(13-7-9-2-1-5-21-9)10-4-3-8(14(17)18)6-11(10)15(19)20/h1-6H,7H2,(H,13,16)