ethyl 4-[[3-[2-(5-bromanyl-1-benzofuran-3-yl)ethanoylamino]-1-benzofuran-2-yl]carbonylamino]benzoate

Systemtic Name: ethyl 4-[[3-[2-(5-bromanyl-1-benzofuran-3-yl)ethanoylamino]-1-benzofuran-2-yl]carbonylamino]benzoate Openeye Name: ethyl 4-[[3-[[2-(5-bromobenzofuran-3-yl)acetyl]amino]benzofuran-2-carbonyl]amino]benzoate CAS Name: 4-[[[3-[[2-(5-bromo-3-benzofuranyl)-1-oxoethyl]amino]-2-benzofuranyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-[[2-(5-bromo-1-benzofuran-3-yl)acetyl]amino]-1-benzofuran-2-carbonyl]amino]benzoate Traditional Name: 4-[[3-[[2-(5-bromobenzofuran-3-yl)acetyl]amino]benzofuran-2-carbonyl]amino]benzoic acid ethyl ester Formula: C28H21BrN2O6 MolecularWeight: 561.38014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3O2)NC(=O)CC4=COC5=C4C=C(C=C5)Br

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3O2)NC(=O)CC4=COC5=C4C=C(C=C5)Br

InChI

InChI=1S/C28H21BrN2O6/c1-2-35-28(34)16-7-10-19(11-8-16)30-27(33)26-25(20-5-3-4-6-23(20)37-26)31-24(32)13-17-15-36-22-12-9-18(29)14-21(17)22/h3-12,14-15H,2,13H2,1H3,(H,30,33)(H,31,32)