3-[2-(2-carboxyethyl)-4-[5-(5,6,7,8-tetrahydronaphthalen-1-yloxy)pentylsulfanylmethyl]-1,3-oxathiolan-2-yl]propanoic acid

Systemtic Name: 3-[2-(2-carboxyethyl)-4-[5-(5,6,7,8-tetrahydronaphthalen-1-yloxy)pentylsulfanylmethyl]-1,3-oxathiolan-2-yl]propanoic acid Openeye Name: 3-[2-(2-carboxyethyl)-4-(5-tetralin-5-yloxypentylsulfanylmethyl)-1,3-oxathiolan-2-yl]propanoic acid CAS Name: 3-[2-(2-carboxyethyl)-4-[[5-(5,6,7,8-tetrahydronaphthalen-1-yloxy)pentylthio]methyl]-1,3-oxathiolan-2-yl]propanoic acid IUPAC Name: 3-[2-(2-carboxyethyl)-4-[5-(5,6,7,8-tetrahydronaphthalen-1-yloxy)pentylsulfanylmethyl]-1,3-oxathiolan-2-yl]propanoic acid Traditional Name: 3-[2-(2-carboxyethyl)-4-[(5-tetralin-5-yloxypentylthio)methyl]-1,3-oxathiolan-2-yl]propionic acid Formula: C25H36O6S2 MolecularWeight: 496.67974

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC=C2OCCCCCSCC3COC(S3)(CCC(=O)O)CCC(=O)O

Isomeric SMILES

C1CCC2=C(C1)C=CC=C2OCCCCCSCC3COC(S3)(CCC(=O)O)CCC(=O)O

InChI

InChI=1S/C25H36O6S2/c26-23(27)11-13-25(14-12-24(28)29)31-17-20(33-25)18-32-16-5-1-4-15-30-22-10-6-8-19-7-2-3-9-21(19)22/h6,8,10,20H,1-5,7,9,11-18H2,(H,26,27)(H,28,29)