(3-fluoranyl-4-methoxy-phenyl)methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 1-(2-thienylsulfonyl)piperidine-4-carboxylate CAS Name: 1-thiophen-2-ylsulfonyl-4-piperidinecarboxylic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-thienylsulfonyl)isonipecotic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C18H20FNO5S2 MolecularWeight: 413.483503

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3)F

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3)F

InChI

InChI=1S/C18H20FNO5S2/c1-24-16-5-4-13(11-15(16)19)12-25-18(21)14-6-8-20(9-7-14)27(22,23)17-3-2-10-26-17/h2-5,10-11,14H,6-9,12H2,1H3