1-[4-[(2-methylpyridin-3-yl)methoxy]phenyl]sulfonyl-5-oxidanyl-piperidine-2-carboxylic acid

Systemtic Name: 1-[4-[(2-methylpyridin-3-yl)methoxy]phenyl]sulfonyl-5-oxidanyl-piperidine-2-carboxylic acid Openeye Name: 5-hydroxy-1-[4-[(2-methyl-3-pyridyl)methoxy]phenyl]sulfonyl-piperidine-2-carboxylic acid CAS Name: 5-hydroxy-1-[4-[(2-methyl-3-pyridinyl)methoxy]phenyl]sulfonyl-2-piperidinecarboxylic acid IUPAC Name: 5-hydroxy-1-[4-[(2-methylpyridin-3-yl)methoxy]phenyl]sulfonylpiperidine-2-carboxylic acid Traditional Name: 5-hydroxy-1-[4-[(2-methyl-3-pyridyl)methoxy]phenyl]sulfonyl-pipecolinic acid Formula: C19H22N2O6S MolecularWeight: 406.45278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=N1)COC2=CC=C(C=C2)S(=O)(=O)N3CC(CCC3C(=O)O)O

Isomeric SMILES

CC1=C(C=CC=N1)COC2=CC=C(C=C2)S(=O)(=O)N3CC(CCC3C(=O)O)O

InChI

InChI=1S/C19H22N2O6S/c1-13-14(3-2-10-20-13)12-27-16-5-7-17(8-6-16)28(25,26)21-11-15(22)4-9-18(21)19(23)24/h2-3,5-8,10,15,18,22H,4,9,11-12H2,1H3,(H,23,24)