4-azanyl-N-[(E)-(2,4-dimorpholin-4-yl-5-nitro-phenyl)methylideneamino]-1,2,5-oxadiazole-3-carboxamide

Systemtic Name: 4-azanyl-N-[(E)-(2,4-dimorpholin-4-yl-5-nitro-phenyl)methylideneamino]-1,2,5-oxadiazole-3-carboxamide Openeye Name: 4-amino-N-[(E)-(2,4-dimorpholino-5-nitro-phenyl)methyleneamino]-1,2,5-oxadiazole-3-carboxamide CAS Name: 4-amino-N-[(E)-[2,4-bis(4-morpholinyl)-5-nitrophenyl]methylideneamino]-1,2,5-oxadiazole-3-carboxamide IUPAC Name: 4-amino-N-[(E)-(2,4-dimorpholin-4-yl-5-nitrophenyl)methylideneamino]-1,2,5-oxadiazole-3-carboxamide Traditional Name: 4-amino-N-[(E)-(2,4-dimorpholino-5-nitro-benzylidene)amino]furazan-3-carboxamide Formula: C18H22N8O6 MolecularWeight: 446.41728

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC(=C(C=C2C=NNC(=O)C3=NON=C3N)[N+](=O)[O-])N4CCOCC4

Isomeric SMILES

C1COCCN1C2=CC(=C(C=C2/C=N/NC(=O)C3=NON=C3N)[N+](=O)[O-])N4CCOCC4

InChI

InChI=1S/C18H22N8O6/c19-17-16(22-32-23-17)18(27)21-20-11-12-9-15(26(28)29)14(25-3-7-31-8-4-25)10-13(12)24-1-5-30-6-2-24/h9-11H,1-8H2,(H2,19,23)(H,21,27)/b20-11+