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

Systemtic Name: N-(3,4-dimethoxyphenyl)-N-(furan-2-ylmethyl)-5-morpholin-4-yl-4-nitro-2,1,3-benzoxadiazol-7-amine Openeye Name: N-(3,4-dimethoxyphenyl)-N-(2-furylmethyl)-5-morpholino-4-nitro-2,1,3-benzoxadiazol-7-amine CAS Name: N-(3,4-dimethoxyphenyl)-N-(2-furanylmethyl)-5-(4-morpholinyl)-4-nitro-2,1,3-benzoxadiazol-7-amine IUPAC Name: N-(3,4-dimethoxyphenyl)-N-(furan-2-ylmethyl)-5-morpholin-4-yl-4-nitro-2,1,3-benzoxadiazol-7-amine Traditional Name: (3,4-dimethoxyphenyl)-(2-furfuryl)-(6-morpholino-7-nitro-benzofurazan-4-yl)amine Formula: C23H23N5O7 MolecularWeight: 481.45802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N5O7/c1-31-19-6-5-15(12-20(19)32-2)27(14-16-4-3-9-34-16)17-13-18(26-7-10-33-11-8-26)23(28(29)30)22-21(17)24-35-25-22/h3-6,9,12-13H,7-8,10-11,14H2,1-2H3