N-(2,5-dimethoxyphenyl)-5-morpholin-4-yl-4-nitro-2,1,3-benzoxadiazol-7-amine

Systemtic Name: N-(2,5-dimethoxyphenyl)-5-morpholin-4-yl-4-nitro-2,1,3-benzoxadiazol-7-amine Openeye Name: N-(2,5-dimethoxyphenyl)-5-morpholino-4-nitro-2,1,3-benzoxadiazol-7-amine CAS Name: N-(2,5-dimethoxyphenyl)-5-(4-morpholinyl)-4-nitro-2,1,3-benzoxadiazol-7-amine IUPAC Name: N-(2,5-dimethoxyphenyl)-5-morpholin-4-yl-4-nitro-2,1,3-benzoxadiazol-7-amine Traditional Name: (2,5-dimethoxyphenyl)-(6-morpholino-7-nitro-benzofurazan-4-yl)amine Formula: C18H19N5O6 MolecularWeight: 401.37336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC2=CC(=C(C3=NON=C23)[N+](=O)[O-])N4CCOCC4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC2=CC(=C(C3=NON=C23)[N+](=O)[O-])N4CCOCC4

InChI

InChI=1S/C18H19N5O6/c1-26-11-3-4-15(27-2)12(9-11)19-13-10-14(22-5-7-28-8-6-22)18(23(24)25)17-16(13)20-29-21-17/h3-4,9-10,19H,5-8H2,1-2H3