6-(4,5-dimethoxy-2-nitro-phenyl)benzo[f][1,3]benzodioxole-5-carbaldehyde

Systemtic Name: 6-(4,5-dimethoxy-2-nitro-phenyl)benzo[f][1,3]benzodioxole-5-carbaldehyde Openeye Name: 6-(4,5-dimethoxy-2-nitro-phenyl)benzo[f][1,3]benzodioxole-5-carbaldehyde CAS Name: 6-(4,5-dimethoxy-2-nitrophenyl)-5-benzo[f][1,3]benzodioxolecarboxaldehyde IUPAC Name: 6-(4,5-dimethoxy-2-nitrophenyl)benzo[f][1,3]benzodioxole-5-carbaldehyde Traditional Name: 6-(4,5-dimethoxy-2-nitro-phenyl)benzo[f][1,3]benzodioxole-5-carbaldehyde Formula: C20H15NO7 MolecularWeight: 381.3356

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C2=C(C3=CC4=C(C=C3C=C2)OCO4)C=O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C2=C(C3=CC4=C(C=C3C=C2)OCO4)C=O)[N+](=O)[O-])OC

InChI

InChI=1S/C20H15NO7/c1-25-17-7-14(16(21(23)24)8-18(17)26-2)12-4-3-11-5-19-20(28-10-27-19)6-13(11)15(12)9-22/h3-9H,10H2,1-2H3