N2,N5-bis[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]furan-2,5-dicarboxamide

Systemtic Name: N2,N5-bis[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]furan-2,5-dicarboxamide Openeye Name: N2,N5-bis[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]furan-2,5-dicarboxamide CAS Name: N2,N5-bis[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]furan-2,5-dicarboxamide IUPAC Name: 2-N,5-N-bis[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylideneamino]furan-2,5-dicarboxamide Traditional Name: N,N'-bis[(E)-(6-nitro-1,3-benzodioxol-5-yl)methyleneamino]furan-2,5-dicarboxamide Formula: C22H14N6O11 MolecularWeight: 538.38016

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NNC(=O)C3=CC=C(O3)C(=O)NN=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)[N+](=O)[O-])/C=N/NC(=O)C3=CC=C(O3)C(=O)N/N=C/C4=CC5=C(OCO5)C=C4[N+](=O)[O-]

InChI

InChI=1S/C22H14N6O11/c29-21(25-23-7-11-3-17-19(37-9-35-17)5-13(11)27(31)32)15-1-2-16(39-15)22(30)26-24-8-12-4-18-20(38-10-36-18)6-14(12)28(33)34/h1-8H,9-10H2,(H,25,29)(H,26,30)/b23-7+,24-8+