N-[5-(hydroxymethyl)-2-methoxy-phenyl]-7-piperidin-4-yloxy-1-benzofuran-5-sulfonamide

Systemtic Name: N-[5-(hydroxymethyl)-2-methoxy-phenyl]-7-piperidin-4-yloxy-1-benzofuran-5-sulfonamide Openeye Name: N-[5-(hydroxymethyl)-2-methoxy-phenyl]-7-(4-piperidyloxy)benzofuran-5-sulfonamide CAS Name: N-[5-(hydroxymethyl)-2-methoxyphenyl]-7-(4-piperidinyloxy)-5-benzofuransulfonamide IUPAC Name: N-[5-(hydroxymethyl)-2-methoxyphenyl]-7-piperidin-4-yloxy-1-benzofuran-5-sulfonamide Traditional Name: N-(2-methoxy-5-methylol-phenyl)-7-(4-piperidyloxy)benzofuran-5-sulfonamide Formula: C21H24N2O6S MolecularWeight: 432.49006

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CO)NS(=O)(=O)C2=CC(=C3C(=C2)C=CO3)OC4CCNCC4

Isomeric SMILES

COC1=C(C=C(C=C1)CO)NS(=O)(=O)C2=CC(=C3C(=C2)C=CO3)OC4CCNCC4

InChI

InChI=1S/C21H24N2O6S/c1-27-19-3-2-14(13-24)10-18(19)23-30(25,26)17-11-15-6-9-28-21(15)20(12-17)29-16-4-7-22-8-5-16/h2-3,6,9-12,16,22-24H,4-5,7-8,13H2,1H3