3,4-bis[3-(2-oxidanylidene-2-propoxy-ethyl)sulfanylpropyl]phthalate

Systemtic Name: 3,4-bis[3-(2-oxidanylidene-2-propoxy-ethyl)sulfanylpropyl]phthalate Openeye Name: 3,4-bis[3-(2-oxo-2-propoxy-ethyl)sulfanylpropyl]phthalate CAS Name: 3,4-bis[3-[(2-oxo-2-propoxyethyl)thio]propyl]phthalate IUPAC Name: 3,4-bis[3-(2-oxo-2-propoxyethyl)sulfanylpropyl]phthalate Traditional Name: 3,4-bis[3-[(2-keto-2-propoxy-ethyl)thio]propyl]phthalate Formula: C24H32O8S2-2 MolecularWeight: 512.63608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CSCCCC1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])CCCSCC(=O)OCCC

Isomeric SMILES

CCCOC(=O)CSCCCC1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])CCCSCC(=O)OCCC

InChI

InChI=1S/C24H34O8S2/c1-3-11-31-20(25)15-33-13-5-7-17-9-10-19(23(27)28)22(24(29)30)18(17)8-6-14-34-16-21(26)32-12-4-2/h9-10H,3-8,11-16H2,1-2H3,(H,27,28)(H,29,30)/p-2