disodium; 8-methylnonan-1-ol; 2-sulfobutanedioic acid

Systemtic Name: disodium; 8-methylnonan-1-ol; 2-sulfobutanedioic acid Openeye Name: disodium; 8-methylnonan-1-ol; 2-sulfobutanedioic acid CAS Name: disodium; 8-methyl-1-nonanol; 2-sulfobutanedioic acid IUPAC Name: disodium; 8-methylnonan-1-ol; 2-sulfobutanedioic acid Traditional Name: disodium; 8-methylnonan-1-ol; 2-sulfosuccinic acid Formula: C14H28Na2O8S+2 MolecularWeight: 402.41186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCO.C(C(C(=O)O)S(=O)(=O)O)C(=O)O.[Na+].[Na+]

Isomeric SMILES

CC(C)CCCCCCCO.C(C(C(=O)O)S(=O)(=O)O)C(=O)O.[Na+].[Na+]

InChI

InChI=1S/C10H22O.C4H6O7S.2Na/c1-10(2)8-6-4-3-5-7-9-11;5-3(6)1-2(4(7)8)12(9,10)11;;/h10-11H,3-9H2,1-2H3;2H,1H2,(H,5,6)(H,7,8)(H,9,10,11);;/q;;2*+1