N-[(3,4-dimethoxyphenyl)methyl]-N-(furan-2-ylmethyl)-5-morpholin-4-yl-4-nitro-2,1,3-benzoxadiazol-7-amine

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-N-(furan-2-ylmethyl)-5-morpholin-4-yl-4-nitro-2,1,3-benzoxadiazol-7-amine Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-N-(2-furylmethyl)-5-morpholino-4-nitro-2,1,3-benzoxadiazol-7-amine CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-N-(2-furanylmethyl)-5-(4-morpholinyl)-4-nitro-2,1,3-benzoxadiazol-7-amine IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-N-(furan-2-ylmethyl)-5-morpholin-4-yl-4-nitro-2,1,3-benzoxadiazol-7-amine Traditional Name: 2-furfuryl-(6-morpholino-7-nitro-benzofurazan-4-yl)-veratryl-amine Formula: C24H25N5O7 MolecularWeight: 495.4846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CC2=CC=CO2)C3=CC(=C(C4=NON=C34)[N+](=O)[O-])N5CCOCC5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CC2=CC=CO2)C3=CC(=C(C4=NON=C34)[N+](=O)[O-])N5CCOCC5)OC

InChI

InChI=1S/C24H25N5O7/c1-32-20-6-5-16(12-21(20)33-2)14-28(15-17-4-3-9-35-17)18-13-19(27-7-10-34-11-8-27)24(29(30)31)23-22(18)25-36-26-23/h3-6,9,12-13H,7-8,10-11,14-15H2,1-2H3