3,4-bis(3-propylsulfanylpropyl)phthalic acid

Systemtic Name: 3,4-bis(3-propylsulfanylpropyl)phthalic acid Openeye Name: 3,4-bis(3-propylsulfanylpropyl)phthalic acid CAS Name: 3,4-bis[3-(propylthio)propyl]phthalic acid IUPAC Name: 3,4-bis(3-propylsulfanylpropyl)phthalic acid Traditional Name: 3,4-bis[3-(propylthio)propyl]phthalic acid Formula: C20H30O4S2 MolecularWeight: 398.5798

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Descriptors Computed from Structure

Canonical SMILES:

CCCSCCCC1=C(C(=C(C=C1)C(=O)O)C(=O)O)CCCSCCC

Isomeric SMILES

CCCSCCCC1=C(C(=C(C=C1)C(=O)O)C(=O)O)CCCSCCC

InChI

InChI=1S/C20H30O4S2/c1-3-11-25-13-5-7-15-9-10-17(19(21)22)18(20(23)24)16(15)8-6-14-26-12-4-2/h9-10H,3-8,11-14H2,1-2H3,(H,21,22)(H,23,24)