5-bromanyl-N-(8-butoxyquinolin-5-yl)-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: 5-bromanyl-N-(8-butoxyquinolin-5-yl)-3-methyl-1-benzofuran-2-carboxamide Openeye Name: 5-bromo-N-(8-butoxy-5-quinolyl)-3-methyl-benzofuran-2-carboxamide CAS Name: 5-bromo-N-(8-butoxy-5-quinolinyl)-3-methyl-2-benzofurancarboxamide IUPAC Name: 5-bromo-N-(8-butoxyquinolin-5-yl)-3-methyl-1-benzofuran-2-carboxamide Traditional Name: 5-bromo-N-(8-butoxy-5-quinolyl)-3-methyl-coumarilamide Formula: C23H21BrN2O3 MolecularWeight: 453.32844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C2C(=C(C=C1)NC(=O)C3=C(C4=C(O3)C=CC(=C4)Br)C)C=CC=N2

Isomeric SMILES

CCCCOC1=C2C(=C(C=C1)NC(=O)C3=C(C4=C(O3)C=CC(=C4)Br)C)C=CC=N2

InChI

InChI=1S/C23H21BrN2O3/c1-3-4-12-28-20-10-8-18(16-6-5-11-25-21(16)20)26-23(27)22-14(2)17-13-15(24)7-9-19(17)29-22/h5-11,13H,3-4,12H2,1-2H3,(H,26,27)