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

Systemtic Name: 4-[(2,6-dimethylpyridin-4-yl)methoxy]-3-oxidanyl-2-piperidin-1-ylsulfonyl-oxane-3-carboxylic acid Openeye Name: 4-[(2,6-dimethyl-4-pyridyl)methoxy]-3-hydroxy-2-(1-piperidylsulfonyl)tetrahydropyran-3-carboxylic acid CAS Name: 4-[(2,6-dimethyl-4-pyridinyl)methoxy]-3-hydroxy-2-(1-piperidinylsulfonyl)-3-oxanecarboxylic acid IUPAC Name: 4-[(2,6-dimethylpyridin-4-yl)methoxy]-3-hydroxy-2-piperidin-1-ylsulfonyloxane-3-carboxylic acid Traditional Name: 4-[(2,6-dimethyl-4-pyridyl)methoxy]-3-hydroxy-2-piperidinosulfonyl-tetrahydropyran-3-carboxylic acid Formula: C19H28N2O7S MolecularWeight: 428.49982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=N1)C)COC2CCOC(C2(C(=O)O)O)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=CC(=CC(=N1)C)COC2CCOC(C2(C(=O)O)O)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C19H28N2O7S/c1-13-10-15(11-14(2)20-13)12-28-16-6-9-27-18(19(16,24)17(22)23)29(25,26)21-7-4-3-5-8-21/h10-11,16,18,24H,3-9,12H2,1-2H3,(H,22,23)