5-(3-fluoranyl-5-methoxy-phenyl)-N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-2,3-dihydro-1-benzofuran-7-sulfonamide

Systemtic Name: 5-(3-fluoranyl-5-methoxy-phenyl)-N-[(2R)-1-(1H-indol-3-yl)-3-oxidanyl-propan-2-yl]-2,3-dihydro-1-benzofuran-7-sulfonamide Openeye Name: 5-(3-fluoro-5-methoxy-phenyl)-N-[(1R)-1-(hydroxymethyl)-2-(1H-indol-3-yl)ethyl]-2,3-dihydrobenzofuran-7-sulfonamide CAS Name: 5-(3-fluoro-5-methoxyphenyl)-N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-2,3-dihydrobenzofuran-7-sulfonamide IUPAC Name: 5-(3-fluoro-5-methoxyphenyl)-N-[(2R)-1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]-2,3-dihydro-1-benzofuran-7-sulfonamide Traditional Name: 5-(3-fluoro-5-methoxy-phenyl)-N-[(1R)-2-hydroxy-1-(1H-indol-3-ylmethyl)ethyl]coumaran-7-sulfonamide Formula: C26H25FN2O5S MolecularWeight: 496.550503

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C2=CC3=C(C(=C2)S(=O)(=O)NC(CC4=CNC5=CC=CC=C54)CO)OCC3)F

Isomeric SMILES

COC1=CC(=CC(=C1)C2=CC3=C(C(=C2)S(=O)(=O)N[C@H](CC4=CNC5=CC=CC=C54)CO)OCC3)F

InChI

InChI=1S/C26H25FN2O5S/c1-33-22-11-18(9-20(27)13-22)17-8-16-6-7-34-26(16)25(12-17)35(31,32)29-21(15-30)10-19-14-28-24-5-3-2-4-23(19)24/h2-5,8-9,11-14,21,28-30H,6-7,10,15H2,1H3/t21-/m1/s1