3,4-bis(3-butylsulfanylpropyl)phthalate

Systemtic Name: 3,4-bis(3-butylsulfanylpropyl)phthalate Openeye Name: 3,4-bis(3-butylsulfanylpropyl)phthalate CAS Name: 3,4-bis[3-(butylthio)propyl]phthalate IUPAC Name: 3,4-bis(3-butylsulfanylpropyl)phthalate Traditional Name: 3,4-bis[3-(butylthio)propyl]phthalate Formula: C22H32O4S2-2 MolecularWeight: 424.61708

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCCC1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])CCCSCCCC

Isomeric SMILES

CCCCSCCCC1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])CCCSCCCC

InChI

InChI=1S/C22H34O4S2/c1-3-5-13-27-15-7-9-17-11-12-19(21(23)24)20(22(25)26)18(17)10-8-16-28-14-6-4-2/h11-12H,3-10,13-16H2,1-2H3,(H,23,24)(H,25,26)/p-2