4-fluoranyl-2-[(3S,4R)-4-oxidanyl-3-(phenylmethyl)-3,4-dihydro-2H-chromen-7-yl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-2-[(3S,4R)-4-oxidanyl-3-(phenylmethyl)-3,4-dihydro-2H-chromen-7-yl]benzenesulfonamide Openeye Name: 2-[(3S,4R)-3-benzyl-4-hydroxy-chroman-7-yl]-4-fluoro-benzenesulfonamide CAS Name: 4-fluoro-2-[(3S,4R)-4-hydroxy-3-(phenylmethyl)-3,4-dihydro-2H-1-benzopyran-7-yl]benzenesulfonamide IUPAC Name: 2-[(3S,4R)-3-benzyl-4-hydroxy-3,4-dihydro-2H-chromen-7-yl]-4-fluorobenzenesulfonamide Traditional Name: 2-[(3S,4R)-3-benzyl-4-hydroxy-chroman-7-yl]-4-fluoro-benzenesulfonamide Formula: C22H20FNO4S MolecularWeight: 413.461903

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C2=C(O1)C=C(C=C2)C3=C(C=CC(=C3)F)S(=O)(=O)N)O)CC4=CC=CC=C4

Isomeric SMILES

C1[C@@H]([C@H](C2=C(O1)C=C(C=C2)C3=C(C=CC(=C3)F)S(=O)(=O)N)O)CC4=CC=CC=C4

InChI

InChI=1S/C22H20FNO4S/c23-17-7-9-21(29(24,26)27)19(12-17)15-6-8-18-20(11-15)28-13-16(22(18)25)10-14-4-2-1-3-5-14/h1-9,11-12,16,22,25H,10,13H2,(H2,24,26,27)/t16-,22+/m0/s1