2,3-bis(2-ethylhexyl)-2,3-disulfo-butanedioic acid

Systemtic Name: 2,3-bis(2-ethylhexyl)-2,3-disulfo-butanedioic acid Openeye Name: 2,3-bis(2-ethylhexyl)-2,3-disulfo-butanedioic acid CAS Name: 2,3-bis(2-ethylhexyl)-2,3-disulfobutanedioic acid IUPAC Name: 2,3-bis(2-ethylhexyl)-2,3-disulfobutanedioic acid Traditional Name: 2,3-bis(2-ethylhexyl)-2,3-disulfo-succinic acid Formula: C20H38O10S2 MolecularWeight: 502.63972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(C(=O)O)(C(CC(CC)CCCC)(C(=O)O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CCCCC(CC)CC(C(=O)O)(C(CC(CC)CCCC)(C(=O)O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C20H38O10S2/c1-5-9-11-15(7-3)13-19(17(21)22,31(25,26)27)20(18(23)24,32(28,29)30)14-16(8-4)12-10-6-2/h15-16H,5-14H2,1-4H3,(H,21,22)(H,23,24)(H,25,26,27)(H,28,29,30)