8-[3-(phenylmethyl)sulfonyl-1,3-thiazolidin-4-yl]octanoic acid

Systemtic Name: 8-[3-(phenylmethyl)sulfonyl-1,3-thiazolidin-4-yl]octanoic acid Openeye Name: 8-(3-benzylsulfonylthiazolidin-4-yl)octanoic acid CAS Name: 8-[3-(phenylmethyl)sulfonyl-4-thiazolidinyl]octanoic acid IUPAC Name: 8-(3-benzylsulfonyl-1,3-thiazolidin-4-yl)octanoic acid Traditional Name: 8-(3-benzylsulfonylthiazolidin-4-yl)caprylic acid Formula: C18H27NO4S2 MolecularWeight: 385.54128

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CS1)S(=O)(=O)CC2=CC=CC=C2)CCCCCCCC(=O)O

Isomeric SMILES

C1C(N(CS1)S(=O)(=O)CC2=CC=CC=C2)CCCCCCCC(=O)O

InChI

InChI=1S/C18H27NO4S2/c20-18(21)12-8-3-1-2-7-11-17-13-24-15-19(17)25(22,23)14-16-9-5-4-6-10-16/h4-6,9-10,17H,1-3,7-8,11-15H2,(H,20,21)