O4-(2-ethylhexyl) O1-sulfo 2-(2-ethylhexyl)butanedioate

Systemtic Name: O4-(2-ethylhexyl) O1-sulfo 2-(2-ethylhexyl)butanedioate Openeye Name: O4-(2-ethylhexyl) O1-sulfo 2-(2-ethylhexyl)butanedioate CAS Name: 2-(2-ethylhexyl)butanedioic acid O4-(2-ethylhexyl) ester O1-sulfo ester IUPAC Name: 4-O-(2-ethylhexyl) 1-O-sulfo 2-(2-ethylhexyl)butanedioate Traditional Name: 2-(2-ethylhexyl)succinic acid O4-(2-ethylhexyl) ester O1-sulfo ester Formula: C20H38O7S MolecularWeight: 422.57652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(CC(=O)OCC(CC)CCCC)C(=O)OS(=O)(=O)O

Isomeric SMILES

CCCCC(CC)CC(CC(=O)OCC(CC)CCCC)C(=O)OS(=O)(=O)O

InChI

InChI=1S/C20H38O7S/c1-5-9-11-16(7-3)13-18(20(22)27-28(23,24)25)14-19(21)26-15-17(8-4)12-10-6-2/h16-18H,5-15H2,1-4H3,(H,23,24,25)