bis(2-ethylhexyl) 5-sulfanylbenzene-1,3-dicarboxylate

Systemtic Name: bis(2-ethylhexyl) 5-sulfanylbenzene-1,3-dicarboxylate Openeye Name: bis(2-ethylhexyl) 5-sulfanylbenzene-1,3-dicarboxylate CAS Name: 5-mercaptobenzene-1,3-dicarboxylic acid bis(2-ethylhexyl) ester IUPAC Name: bis(2-ethylhexyl) 5-sulfanylbenzene-1,3-dicarboxylate Traditional Name: 5-mercaptobenzene-1,3-dicarboxylic acid bis(2-ethylhexyl) ester Formula: C24H38O4S MolecularWeight: 422.62112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C1=CC(=CC(=C1)S)C(=O)OCC(CC)CCCC

Isomeric SMILES

CCCCC(CC)COC(=O)C1=CC(=CC(=C1)S)C(=O)OCC(CC)CCCC

InChI

InChI=1S/C24H38O4S/c1-5-9-11-18(7-3)16-27-23(25)20-13-21(15-22(29)14-20)24(26)28-17-19(8-4)12-10-6-2/h13-15,18-19,29H,5-12,16-17H2,1-4H3