7-bromanyl-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-1-benzofuran-2-carboxamide

Systemtic Name: 7-bromanyl-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-1-benzofuran-2-carboxamide Openeye Name: 7-bromo-N-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]benzofuran-2-carboxamide CAS Name: 7-bromo-N-[1-(4-methoxyphenyl)sulfonyl-4-piperidinyl]-2-benzofurancarboxamide IUPAC Name: 7-bromo-N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-1-benzofuran-2-carboxamide Traditional Name: 7-bromo-N-[1-(4-methoxyphenyl)sulfonyl-4-piperidyl]coumarilamide Formula: C21H21BrN2O5S MolecularWeight: 493.37084

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=CC4=C(O3)C(=CC=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=CC4=C(O3)C(=CC=C4)Br

InChI

InChI=1S/C21H21BrN2O5S/c1-28-16-5-7-17(8-6-16)30(26,27)24-11-9-15(10-12-24)23-21(25)19-13-14-3-2-4-18(22)20(14)29-19/h2-8,13,15H,9-12H2,1H3,(H,23,25)