1-[4-(2,6-dimethylpyridin-4-yl)oxyphenyl]sulfonyl-3-oxidanyl-piperidine-3-carboxylic acid

Systemtic Name: 1-[4-(2,6-dimethylpyridin-4-yl)oxyphenyl]sulfonyl-3-oxidanyl-piperidine-3-carboxylic acid Openeye Name: 1-[4-[(2,6-dimethyl-4-pyridyl)oxy]phenyl]sulfonyl-3-hydroxy-piperidine-3-carboxylic acid CAS Name: 1-[4-[(2,6-dimethyl-4-pyridinyl)oxy]phenyl]sulfonyl-3-hydroxy-3-piperidinecarboxylic acid IUPAC Name: 1-[4-(2,6-dimethylpyridin-4-yl)oxyphenyl]sulfonyl-3-hydroxypiperidine-3-carboxylic acid Traditional Name: 1-[4-[(2,6-dimethyl-4-pyridyl)oxy]phenyl]sulfonyl-3-hydroxy-nipecotic acid Formula: C19H22N2O6S MolecularWeight: 406.45278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=N1)C)OC2=CC=C(C=C2)S(=O)(=O)N3CCCC(C3)(C(=O)O)O

Isomeric SMILES

CC1=CC(=CC(=N1)C)OC2=CC=C(C=C2)S(=O)(=O)N3CCCC(C3)(C(=O)O)O

InChI

InChI=1S/C19H22N2O6S/c1-13-10-16(11-14(2)20-13)27-15-4-6-17(7-5-15)28(25,26)21-9-3-8-19(24,12-21)18(22)23/h4-7,10-11,24H,3,8-9,12H2,1-2H3,(H,22,23)