4-oxidanylidene-4-[4-[4-(4-oxidanyl-4-oxidanylidene-butanoyl)phenyl]sulfanylphenyl]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[4-[4-(4-oxidanyl-4-oxidanylidene-butanoyl)phenyl]sulfanylphenyl]butanoic acid Openeye Name: 4-[4-[4-(4-hydroxy-4-oxo-butanoyl)phenyl]sulfanylphenyl]-4-oxo-butanoic acid CAS Name: 4-[4-[[4-(4-hydroxy-1,4-dioxobutyl)phenyl]thio]phenyl]-4-oxobutanoic acid IUPAC Name: 4-[4-[4-(4-hydroxy-4-oxobutanoyl)phenyl]sulfanylphenyl]-4-oxobutanoic acid Traditional Name: 4-[4-[[4-(4-hydroxy-4-keto-butanoyl)phenyl]thio]phenyl]-4-keto-butyric acid Formula: C20H18O6S MolecularWeight: 386.41832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCC(=O)O)SC2=CC=C(C=C2)C(=O)CCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCC(=O)O)SC2=CC=C(C=C2)C(=O)CCC(=O)O

InChI

InChI=1S/C20H18O6S/c21-17(9-11-19(23)24)13-1-5-15(6-2-13)27-16-7-3-14(4-8-16)18(22)10-12-20(25)26/h1-8H,9-12H2,(H,23,24)(H,25,26)