N-[(E)-(4-methoxy-3-nitro-phenyl)methylideneamino]-4-methyl-5-oxidanidyl-1,2,5-oxadiazol-5-ium-3-carboxamide

Systemtic Name: N-[(E)-(4-methoxy-3-nitro-phenyl)methylideneamino]-4-methyl-5-oxidanidyl-1,2,5-oxadiazol-5-ium-3-carboxamide Openeye Name: N-[(E)-(4-methoxy-3-nitro-phenyl)methyleneamino]-4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-carboxamide CAS Name: N-[(E)-(4-methoxy-3-nitrophenyl)methylideneamino]-4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-carboxamide IUPAC Name: N-[(E)-(4-methoxy-3-nitrophenyl)methylideneamino]-4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-carboxamide Traditional Name: N-[(E)-(4-methoxy-3-nitro-benzylidene)amino]-4-methyl-5-oxido-furazan-5-ium-3-carboxamide Formula: C12H11N5O6 MolecularWeight: 321.24564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](ON=C1C(=O)NN=CC2=CC(=C(C=C2)OC)[N+](=O)[O-])[O-]

Isomeric SMILES

CC1=[N+](ON=C1C(=O)N/N=C/C2=CC(=C(C=C2)OC)[N+](=O)[O-])[O-]

InChI

InChI=1S/C12H11N5O6/c1-7-11(15-23-17(7)21)12(18)14-13-6-8-3-4-10(22-2)9(5-8)16(19)20/h3-6H,1-2H3,(H,14,18)/b13-6+