4-[[2-(2-aminophenyl)-3-bromanyl-1-benzofuran-5-yl]methyl]-5-ethyl-furan-3-one

Systemtic Name: 4-[[2-(2-aminophenyl)-3-bromanyl-1-benzofuran-5-yl]methyl]-5-ethyl-furan-3-one Openeye Name: 4-[[2-(2-aminophenyl)-3-bromo-benzofuran-5-yl]methyl]-5-ethyl-furan-3-one CAS Name: 4-[[2-(2-aminophenyl)-3-bromo-5-benzofuranyl]methyl]-5-ethyl-3-furanone IUPAC Name: 4-[[2-(2-aminophenyl)-3-bromo-1-benzofuran-5-yl]methyl]-5-ethylfuran-3-one Traditional Name: 4-[[2-(2-aminophenyl)-3-bromo-benzofuran-5-yl]methyl]-5-ethyl-furan-3-one Formula: C21H18BrNO3 MolecularWeight: 412.27652

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)CO1)CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4N

Isomeric SMILES

CCC1=C(C(=O)CO1)CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4N

InChI

InChI=1S/C21H18BrNO3/c1-2-18-14(17(24)11-25-18)9-12-7-8-19-15(10-12)20(22)21(26-19)13-5-3-4-6-16(13)23/h3-8,10H,2,9,11,23H2,1H3