(3-fluorophenyl)methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: (3-fluorophenyl)methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Openeye Name: (3-fluorophenyl)methyl 1-(2-thienylsulfonyl)piperidine-4-carboxylate CAS Name: 1-thiophen-2-ylsulfonyl-4-piperidinecarboxylic acid (3-fluorophenyl)methyl ester IUPAC Name: (3-fluorophenyl)methyl 1-thiophen-2-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-thienylsulfonyl)isonipecotic acid (3-fluorobenzyl) ester Formula: C17H18FNO4S2 MolecularWeight: 383.457523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=CC(=CC=C2)F)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=CC(=CC=C2)F)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C17H18FNO4S2/c18-15-4-1-3-13(11-15)12-23-17(20)14-6-8-19(9-7-14)25(21,22)16-5-2-10-24-16/h1-5,10-11,14H,6-9,12H2