[4-[(E)-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylhydrazinylidene)methyl]-2-methoxy-phenyl] 4-bromanylbenzoate

Systemtic Name: [4-[(E)-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylhydrazinylidene)methyl]-2-methoxy-phenyl] 4-bromanylbenzoate Openeye Name: [4-[(E)-(2,3-dihydro-1,4-benzodioxine-6-carbonylhydrazono)methyl]-2-methoxy-phenyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [4-[(E)-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-(2,3-dihydro-1,4-benzodioxine-6-carbonylhydrazinylidene)methyl]-2-methoxyphenyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [4-[(E)-(2,3-dihydro-1,4-benzodioxin-6-carbonylhydrazono)methyl]-2-methoxy-phenyl] ester Formula: C24H19BrN2O6 MolecularWeight: 511.32146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=O)C2=CC3=C(C=C2)OCCO3)OC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=O)C2=CC3=C(C=C2)OCCO3)OC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C24H19BrN2O6/c1-30-21-12-15(2-8-20(21)33-24(29)16-3-6-18(25)7-4-16)14-26-27-23(28)17-5-9-19-22(13-17)32-11-10-31-19/h2-9,12-14H,10-11H2,1H3,(H,27,28)/b26-14+