[4-[(E)-[2-(4-bromanylphenoxy)propanoylhydrazinylidene]methyl]-2-ethoxy-phenyl] 4-propoxybenzoate

Systemtic Name: [4-[(E)-[2-(4-bromanylphenoxy)propanoylhydrazinylidene]methyl]-2-ethoxy-phenyl] 4-propoxybenzoate Openeye Name: [4-[(E)-[2-(4-bromophenoxy)propanoylhydrazono]methyl]-2-ethoxy-phenyl] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [4-[(E)-[[2-(4-bromophenoxy)-1-oxopropyl]hydrazinylidene]methyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[(E)-[2-(4-bromophenoxy)propanoylhydrazinylidene]methyl]-2-ethoxyphenyl] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [4-[(E)-[2-(4-bromophenoxy)propanoylhydrazono]methyl]-2-ethoxy-phenyl] ester Formula: C28H29BrN2O6 MolecularWeight: 569.44366

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)C=NNC(=O)C(C)OC3=CC=C(C=C3)Br)OCC

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)/C=N/NC(=O)C(C)OC3=CC=C(C=C3)Br)OCC

InChI

InChI=1S/C28H29BrN2O6/c1-4-16-35-23-11-7-21(8-12-23)28(33)37-25-15-6-20(17-26(25)34-5-2)18-30-31-27(32)19(3)36-24-13-9-22(29)10-14-24/h6-15,17-19H,4-5,16H2,1-3H3,(H,31,32)/b30-18+