2-[4-(2-cyclooctyloxyethylsulfanyl)phenyl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[4-(2-cyclooctyloxyethylsulfanyl)phenyl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-[2-(cyclooctoxy)ethylsulfanyl]phenyl]-2-oxo-acetic acid CAS Name: 2-[4-(2-cyclooctyloxyethylthio)phenyl]-2-oxoacetic acid IUPAC Name: 2-[4-(2-cyclooctyloxyethylsulfanyl)phenyl]-2-oxoacetic acid Traditional Name: 2-[4-[2-(cyclooctoxy)ethylthio]phenyl]-2-keto-acetic acid Formula: C18H24O4S MolecularWeight: 336.44576

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)OCCSC2=CC=C(C=C2)C(=O)C(=O)O

Isomeric SMILES

C1CCCC(CCC1)OCCSC2=CC=C(C=C2)C(=O)C(=O)O

InChI

InChI=1S/C18H24O4S/c19-17(18(20)21)14-8-10-16(11-9-14)23-13-12-22-15-6-4-2-1-3-5-7-15/h8-11,15H,1-7,12-13H2,(H,20,21)