4-(2,6-dimethylpyridin-4-yl)oxy-3-oxidanyl-2-piperidin-1-ylsulfonyl-oxane-3-carboxylic acid

Systemtic Name: 4-(2,6-dimethylpyridin-4-yl)oxy-3-oxidanyl-2-piperidin-1-ylsulfonyl-oxane-3-carboxylic acid Openeye Name: 4-[(2,6-dimethyl-4-pyridyl)oxy]-3-hydroxy-2-(1-piperidylsulfonyl)tetrahydropyran-3-carboxylic acid CAS Name: 4-[(2,6-dimethyl-4-pyridinyl)oxy]-3-hydroxy-2-(1-piperidinylsulfonyl)-3-oxanecarboxylic acid IUPAC Name: 4-(2,6-dimethylpyridin-4-yl)oxy-3-hydroxy-2-piperidin-1-ylsulfonyloxane-3-carboxylic acid Traditional Name: 4-[(2,6-dimethyl-4-pyridyl)oxy]-3-hydroxy-2-piperidinosulfonyl-tetrahydropyran-3-carboxylic acid Formula: C18H26N2O7S MolecularWeight: 414.47324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=N1)C)OC2CCOC(C2(C(=O)O)O)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=CC(=CC(=N1)C)OC2CCOC(C2(C(=O)O)O)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C18H26N2O7S/c1-12-10-14(11-13(2)19-12)27-15-6-9-26-17(18(15,23)16(21)22)28(24,25)20-7-4-3-5-8-20/h10-11,15,17,23H,3-9H2,1-2H3,(H,21,22)