5-[[4-[[(5-bromanyl-7-methoxy-1-benzofuran-2-yl)carbonylhydrazinylidene]methyl]-2-ethoxy-phenoxy]methyl]furan-2-carboxylic acid

Systemtic Name: 5-[[4-[[(5-bromanyl-7-methoxy-1-benzofuran-2-yl)carbonylhydrazinylidene]methyl]-2-ethoxy-phenoxy]methyl]furan-2-carboxylic acid Openeye Name: 5-[[4-[[(5-bromo-7-methoxy-benzofuran-2-carbonyl)hydrazono]methyl]-2-ethoxy-phenoxy]methyl]furan-2-carboxylic acid CAS Name: 5-[[4-[[[(5-bromo-7-methoxy-2-benzofuranyl)-oxomethyl]hydrazinylidene]methyl]-2-ethoxyphenoxy]methyl]-2-furancarboxylic acid IUPAC Name: 5-[[4-[[(5-bromo-7-methoxy-1-benzofuran-2-carbonyl)hydrazinylidene]methyl]-2-ethoxyphenoxy]methyl]furan-2-carboxylic acid Traditional Name: 5-[[4-[[(5-bromo-7-methoxy-benzofuran-2-carbonyl)hydrazono]methyl]-2-ethoxy-phenoxy]methyl]-2-furoic acid Formula: C25H21BrN2O8 MolecularWeight: 557.34684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NNC(=O)C2=CC3=CC(=CC(=C3O2)OC)Br)OCC4=CC=C(O4)C(=O)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=NNC(=O)C2=CC3=CC(=CC(=C3O2)OC)Br)OCC4=CC=C(O4)C(=O)O

InChI

InChI=1S/C25H21BrN2O8/c1-3-33-20-8-14(4-6-18(20)34-13-17-5-7-19(35-17)25(30)31)12-27-28-24(29)22-10-15-9-16(26)11-21(32-2)23(15)36-22/h4-12H,3,13H2,1-2H3,(H,28,29)(H,30,31)