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

Systemtic Name: methyl 3-[5-[(E)-(1,3-benzodioxol-5-ylcarbonylhydrazinylidene)methyl]furan-2-yl]benzoate Openeye Name: methyl 3-[5-[(E)-(1,3-benzodioxole-5-carbonylhydrazono)methyl]-2-furyl]benzoate CAS Name: 3-[5-[(E)-[[1,3-benzodioxol-5-yl(oxo)methyl]hydrazinylidene]methyl]-2-furanyl]benzoic acid methyl ester IUPAC Name: methyl 3-[5-[(E)-(1,3-benzodioxole-5-carbonylhydrazinylidene)methyl]furan-2-yl]benzoate Traditional Name: 3-[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=CC(=C1)C2=CC=C(O2)C=NNC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

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

InChI

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