methyl 4-[5-[(E)-(1,3-benzodioxol-5-ylcarbonylhydrazinylidene)methyl]furan-2-yl]benzoate

Systemtic Name: methyl 4-[5-[(E)-(1,3-benzodioxol-5-ylcarbonylhydrazinylidene)methyl]furan-2-yl]benzoate Openeye Name: methyl 4-[5-[(E)-(1,3-benzodioxole-5-carbonylhydrazono)methyl]-2-furyl]benzoate CAS Name: 4-[5-[(E)-[[1,3-benzodioxol-5-yl(oxo)methyl]hydrazinylidene]methyl]-2-furanyl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-[(E)-(1,3-benzodioxole-5-carbonylhydrazinylidene)methyl]furan-2-yl]benzoate Traditional Name: 4-[5-[(E)-(piperonyloylhydrazono)methyl]-2-furyl]benzoic acid methyl ester Formula: C21H16N2O6 MolecularWeight: 392.36154

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=NNC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=N/NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H16N2O6/c1-26-21(25)14-4-2-13(3-5-14)17-9-7-16(29-17)11-22-23-20(24)15-6-8-18-19(10-15)28-12-27-18/h2-11H,12H2,1H3,(H,23,24)/b22-11+