4-oxidanyl-5-(3-phenylmethoxypropyl)thiolane-3-carboxylic acid

Systemtic Name: 4-oxidanyl-5-(3-phenylmethoxypropyl)thiolane-3-carboxylic acid Openeye Name: 5-(3-benzyloxypropyl)-4-hydroxy-tetrahydrothiophene-3-carboxylic acid CAS Name: 4-hydroxy-5-(3-phenylmethoxypropyl)-3-thiolanecarboxylic acid IUPAC Name: 4-hydroxy-5-(3-phenylmethoxypropyl)thiolane-3-carboxylic acid Traditional Name: 5-(3-benzoxypropyl)-4-hydroxy-tetrahydrothiophene-3-carboxylic acid Formula: C15H20O4S MolecularWeight: 296.3819

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(S1)CCCOCC2=CC=CC=C2)O)C(=O)O

Isomeric SMILES

C1C(C(C(S1)CCCOCC2=CC=CC=C2)O)C(=O)O

InChI

InChI=1S/C15H20O4S/c16-14-12(15(17)18)10-20-13(14)7-4-8-19-9-11-5-2-1-3-6-11/h1-3,5-6,12-14,16H,4,7-10H2,(H,17,18)