(5-fluoranyl-2-methoxy-phenyl)methyl 4-fluoranyl-3-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (5-fluoranyl-2-methoxy-phenyl)methyl 4-fluoranyl-3-piperidin-1-ylsulfonyl-benzoate Openeye Name: (5-fluoro-2-methoxy-phenyl)methyl 4-fluoro-3-(1-piperidylsulfonyl)benzoate CAS Name: 4-fluoro-3-(1-piperidinylsulfonyl)benzoic acid (5-fluoro-2-methoxyphenyl)methyl ester IUPAC Name: (5-fluoro-2-methoxyphenyl)methyl 4-fluoro-3-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-fluoro-3-piperidinosulfonyl-benzoic acid (5-fluoro-2-methoxy-benzyl) ester Formula: C20H21F2NO5S MolecularWeight: 425.446246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)COC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)F)COC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H21F2NO5S/c1-27-18-8-6-16(21)11-15(18)13-28-20(24)14-5-7-17(22)19(12-14)29(25,26)23-9-3-2-4-10-23/h5-8,11-12H,2-4,9-10,13H2,1H3