N-[3-fluoranyl-4-[[5-(4-methoxyphenyl)carbonyl-1-methyl-pyrrol-2-yl]methyl]phenyl]-2-oxidanyl-ethanesulfonamide

Systemtic Name: N-[3-fluoranyl-4-[[5-(4-methoxyphenyl)carbonyl-1-methyl-pyrrol-2-yl]methyl]phenyl]-2-oxidanyl-ethanesulfonamide Openeye Name: N-[3-fluoro-4-[[5-(4-methoxybenzoyl)-1-methyl-pyrrol-2-yl]methyl]phenyl]-2-hydroxy-ethanesulfonamide CAS Name: N-[3-fluoro-4-[[5-[(4-methoxyphenyl)-oxomethyl]-1-methyl-2-pyrrolyl]methyl]phenyl]-2-hydroxyethanesulfonamide IUPAC Name: N-[3-fluoro-4-[[5-(4-methoxybenzoyl)-1-methylpyrrol-2-yl]methyl]phenyl]-2-hydroxyethanesulfonamide Traditional Name: N-[3-fluoro-4-[(1-methyl-5-p-anisoyl-pyrrol-2-yl)methyl]phenyl]-2-hydroxy-ethanesulfonamide Formula: C22H23FN2O5S MolecularWeight: 446.491823

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C(=O)C2=CC=C(C=C2)OC)CC3=C(C=C(C=C3)NS(=O)(=O)CCO)F

Isomeric SMILES

CN1C(=CC=C1C(=O)C2=CC=C(C=C2)OC)CC3=C(C=C(C=C3)NS(=O)(=O)CCO)F

InChI

InChI=1S/C22H23FN2O5S/c1-25-18(7-10-21(25)22(27)15-4-8-19(30-2)9-5-15)13-16-3-6-17(14-20(16)23)24-31(28,29)12-11-26/h3-10,14,24,26H,11-13H2,1-2H3