[4-[(E)-[2-(2-cyanophenoxy)ethanoylhydrazinylidene]methyl]-2-methoxy-phenyl] 4-bromanylbenzoate

Systemtic Name: [4-[(E)-[2-(2-cyanophenoxy)ethanoylhydrazinylidene]methyl]-2-methoxy-phenyl] 4-bromanylbenzoate Openeye Name: [4-[(E)-[[2-(2-cyanophenoxy)acetyl]hydrazono]methyl]-2-methoxy-phenyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [4-[(E)-[[2-(2-cyanophenoxy)-1-oxoethyl]hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-[[2-(2-cyanophenoxy)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [4-[(E)-[[2-(2-cyanophenoxy)acetyl]hydrazono]methyl]-2-methoxy-phenyl] ester Formula: C24H18BrN3O5 MolecularWeight: 508.32082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=O)COC2=CC=CC=C2C#N)OC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC(=O)COC2=CC=CC=C2C#N)OC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C24H18BrN3O5/c1-31-22-12-16(6-11-21(22)33-24(30)17-7-9-19(25)10-8-17)14-27-28-23(29)15-32-20-5-3-2-4-18(20)13-26/h2-12,14H,15H2,1H3,(H,28,29)/b27-14+