3,4,5,6-tetrakis(decylsulfanyl)phthalic acid

Systemtic Name: 3,4,5,6-tetrakis(decylsulfanyl)phthalic acid Openeye Name: 3,4,5,6-tetrakis(decylsulfanyl)phthalic acid CAS Name: 3,4,5,6-tetrakis(decylthio)phthalic acid IUPAC Name: 3,4,5,6-tetrakis(decylsulfanyl)phthalic acid Traditional Name: 3,4,5,6-tetrakis(decylthio)phthalic acid Formula: C48H86O4S4 MolecularWeight: 855.45404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCSC1=C(C(=C(C(=C1C(=O)O)C(=O)O)SCCCCCCCCCC)SCCCCCCCCCC)SCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCSC1=C(C(=C(C(=C1C(=O)O)C(=O)O)SCCCCCCCCCC)SCCCCCCCCCC)SCCCCCCCCCC

InChI

InChI=1S/C48H86O4S4/c1-5-9-13-17-21-25-29-33-37-53-43-41(47(49)50)42(48(51)52)44(54-38-34-30-26-22-18-14-10-6-2)46(56-40-36-32-28-24-20-16-12-8-4)45(43)55-39-35-31-27-23-19-15-11-7-3/h5-40H2,1-4H3,(H,49,50)(H,51,52)