N-(4-methyl-3-nitro-phenyl)-5-nitro-furan-2-carboxamide

Systemtic Name: N-(4-methyl-3-nitro-phenyl)-5-nitro-furan-2-carboxamide Openeye Name: N-(4-methyl-3-nitro-phenyl)-5-nitro-furan-2-carboxamide CAS Name: N-(4-methyl-3-nitrophenyl)-5-nitro-2-furancarboxamide IUPAC Name: N-(4-methyl-3-nitrophenyl)-5-nitrofuran-2-carboxamide Traditional Name: N-(4-methyl-3-nitro-phenyl)-5-nitro-2-furamide Formula: C12H9N3O6 MolecularWeight: 291.21636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(O2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(O2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H9N3O6/c1-7-2-3-8(6-9(7)14(17)18)13-12(16)10-4-5-11(21-10)15(19)20/h2-6H,1H3,(H,13,16)