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

Systemtic Name: 2-oxidanylidene-2-[4-(4-phenylsulfanylbutoxy)phenyl]ethanoic acid Openeye Name: 2-oxo-2-[4-(4-phenylsulfanylbutoxy)phenyl]acetic acid CAS Name: 2-oxo-2-[4-[4-(phenylthio)butoxy]phenyl]acetic acid IUPAC Name: 2-oxo-2-[4-(4-phenylsulfanylbutoxy)phenyl]acetic acid Traditional Name: 2-keto-2-[4-[4-(phenylthio)butoxy]phenyl]acetic acid Formula: C18H18O4S MolecularWeight: 330.39812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCCOC2=CC=C(C=C2)C(=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)SCCCCOC2=CC=C(C=C2)C(=O)C(=O)O

InChI

InChI=1S/C18H18O4S/c19-17(18(20)21)14-8-10-15(11-9-14)22-12-4-5-13-23-16-6-2-1-3-7-16/h1-3,6-11H,4-5,12-13H2,(H,20,21)