1-[4-[(4-fluorophenyl)methoxy]phenyl]sulfonyl-3-methoxy-piperidine-2-carboxylic acid

Systemtic Name: 1-[4-[(4-fluorophenyl)methoxy]phenyl]sulfonyl-3-methoxy-piperidine-2-carboxylic acid Openeye Name: 1-[4-[(4-fluorophenyl)methoxy]phenyl]sulfonyl-3-methoxy-piperidine-2-carboxylic acid CAS Name: 1-[4-[(4-fluorophenyl)methoxy]phenyl]sulfonyl-3-methoxy-2-piperidinecarboxylic acid IUPAC Name: 1-[4-[(4-fluorophenyl)methoxy]phenyl]sulfonyl-3-methoxypiperidine-2-carboxylic acid Traditional Name: 1-[4-(4-fluorobenzyl)oxyphenyl]sulfonyl-3-methoxy-pipecolinic acid Formula: C20H22FNO6S MolecularWeight: 423.455183

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCCN(C1C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OCC3=CC=C(C=C3)F

Isomeric SMILES

COC1CCCN(C1C(=O)O)S(=O)(=O)C2=CC=C(C=C2)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FNO6S/c1-27-18-3-2-12-22(19(18)20(23)24)29(25,26)17-10-8-16(9-11-17)28-13-14-4-6-15(21)7-5-14/h4-11,18-19H,2-3,12-13H2,1H3,(H,23,24)