N-[[3-fluoranyl-4-(4-oxidanylpiperidin-1-yl)phenyl]methyl]-4-methylsulfonyl-benzamide

Systemtic Name: N-[[3-fluoranyl-4-(4-oxidanylpiperidin-1-yl)phenyl]methyl]-4-methylsulfonyl-benzamide Openeye Name: N-[[3-fluoro-4-(4-hydroxy-1-piperidyl)phenyl]methyl]-4-methylsulfonyl-benzamide CAS Name: N-[[3-fluoro-4-(4-hydroxy-1-piperidinyl)phenyl]methyl]-4-methylsulfonylbenzamide IUPAC Name: N-[[3-fluoro-4-(4-hydroxypiperidin-1-yl)phenyl]methyl]-4-methylsulfonylbenzamide Traditional Name: N-[3-fluoro-4-(4-hydroxypiperidino)benzyl]-4-mesyl-benzamide Formula: C20H23FN2O4S MolecularWeight: 406.471023

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NCC2=CC(=C(C=C2)N3CCC(CC3)O)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)NCC2=CC(=C(C=C2)N3CCC(CC3)O)F

InChI

InChI=1S/C20H23FN2O4S/c1-28(26,27)17-5-3-15(4-6-17)20(25)22-13-14-2-7-19(18(21)12-14)23-10-8-16(24)9-11-23/h2-7,12,16,24H,8-11,13H2,1H3,(H,22,25)