2-oxidanyl-4-[5-(phenylsulfonyl)-3-sulfanylidene-pentoxy]benzoic acid

Systemtic Name: 2-oxidanyl-4-[5-(phenylsulfonyl)-3-sulfanylidene-pentoxy]benzoic acid Openeye Name: 4-[5-(benzenesulfonyl)-3-thioxo-pentoxy]-2-hydroxy-benzoic acid CAS Name: 4-[5-(benzenesulfonyl)-3-sulfanylidenepentoxy]-2-hydroxybenzoic acid IUPAC Name: 4-[5-(benzenesulfonyl)-3-sulfanylidenepentoxy]-2-hydroxybenzoic acid Traditional Name: 4-(5-besyl-3-thioxo-pentoxy)-2-hydroxy-benzoic acid Formula: C18H18O6S2 MolecularWeight: 394.46192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCC(=S)CCOC2=CC(=C(C=C2)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCC(=S)CCOC2=CC(=C(C=C2)C(=O)O)O

InChI

InChI=1S/C18H18O6S2/c19-17-12-13(6-7-16(17)18(20)21)24-10-8-14(25)9-11-26(22,23)15-4-2-1-3-5-15/h1-7,12,19H,8-11H2,(H,20,21)