4-[(3-chlorophenyl)methoxy]-3-oxidanyl-2-piperidin-1-ylsulfonyl-oxane-3-carboxylic acid

Systemtic Name: 4-[(3-chlorophenyl)methoxy]-3-oxidanyl-2-piperidin-1-ylsulfonyl-oxane-3-carboxylic acid Openeye Name: 4-[(3-chlorophenyl)methoxy]-3-hydroxy-2-(1-piperidylsulfonyl)tetrahydropyran-3-carboxylic acid CAS Name: 4-[(3-chlorophenyl)methoxy]-3-hydroxy-2-(1-piperidinylsulfonyl)-3-oxanecarboxylic acid IUPAC Name: 4-[(3-chlorophenyl)methoxy]-3-hydroxy-2-piperidin-1-ylsulfonyloxane-3-carboxylic acid Traditional Name: 4-(3-chlorobenzyl)oxy-3-hydroxy-2-piperidinosulfonyl-tetrahydropyran-3-carboxylic acid Formula: C18H24ClNO7S MolecularWeight: 433.90366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2C(C(CCO2)OCC3=CC(=CC=C3)Cl)(C(=O)O)O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2C(C(CCO2)OCC3=CC(=CC=C3)Cl)(C(=O)O)O

InChI

InChI=1S/C18H24ClNO7S/c19-14-6-4-5-13(11-14)12-27-15-7-10-26-17(18(15,23)16(21)22)28(24,25)20-8-2-1-3-9-20/h4-6,11,15,17,23H,1-3,7-10,12H2,(H,21,22)