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

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 5-morpholin-4-ylsulfonyl-2-piperidin-1-yl-benzoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 5-morpholinosulfonyl-2-(1-piperidyl)benzoate CAS Name: 5-(4-morpholinylsulfonyl)-2-(1-piperidinyl)benzoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 5-morpholin-4-ylsulfonyl-2-piperidin-1-ylbenzoate Traditional Name: 5-morpholinosulfonyl-2-piperidino-benzoic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C24H29FN2O6S MolecularWeight: 492.560263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCC4)F

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)N4CCCCC4)F

InChI

InChI=1S/C24H29FN2O6S/c1-31-23-8-5-18(15-21(23)25)17-33-24(28)20-16-19(34(29,30)27-11-13-32-14-12-27)6-7-22(20)26-9-3-2-4-10-26/h5-8,15-16H,2-4,9-14,17H2,1H3