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

Systemtic Name: 3,4-bis(3-cyclopentylsulfanylpropyl)phthalic acid Openeye Name: 3,4-bis(3-cyclopentylsulfanylpropyl)phthalic acid CAS Name: 3,4-bis[3-(cyclopentylthio)propyl]phthalic acid IUPAC Name: 3,4-bis(3-cyclopentylsulfanylpropyl)phthalic acid Traditional Name: 3,4-bis[3-(cyclopentylthio)propyl]phthalic acid Formula: C24H34O4S2 MolecularWeight: 450.65436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)SCCCC2=C(C(=C(C=C2)C(=O)O)C(=O)O)CCCSC3CCCC3

Isomeric SMILES

C1CCC(C1)SCCCC2=C(C(=C(C=C2)C(=O)O)C(=O)O)CCCSC3CCCC3

InChI

InChI=1S/C24H34O4S2/c25-23(26)21-14-13-17(7-5-15-29-18-8-1-2-9-18)20(22(21)24(27)28)12-6-16-30-19-10-3-4-11-19/h13-14,18-19H,1-12,15-16H2,(H,25,26)(H,27,28)