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

Systemtic Name: [4-[(E)-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylhydrazinylidene)methyl]-2-methoxy-phenyl] 4-nitrobenzoate Openeye Name: [4-[(E)-(2,3-dihydro-1,4-benzodioxine-6-carbonylhydrazono)methyl]-2-methoxy-phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic 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-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-[(E)-(2,3-dihydro-1,4-benzodioxin-6-carbonylhydrazono)methyl]-2-methoxy-phenyl] ester Formula: C24H19N3O8 MolecularWeight: 477.42296

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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)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=O)C2=CC3=C(C=C2)OCCO3)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H19N3O8/c1-32-21-12-15(2-8-20(21)35-24(29)16-3-6-18(7-4-16)27(30)31)14-25-26-23(28)17-5-9-19-22(13-17)34-11-10-33-19/h2-9,12-14H,10-11H2,1H3,(H,26,28)/b25-14+