disodium; dodecanoate; 2-(1-hydroxyethylamino)-2-sulfo-butanedioate

Systemtic Name: disodium; dodecanoate; 2-(1-hydroxyethylamino)-2-sulfo-butanedioate Openeye Name: disodium; dodecanoate; 2-(1-hydroxyethylamino)-2-sulfo-butanedioate CAS Name: disodium; dodecanoate; 2-(1-hydroxyethylamino)-2-sulfobutanedioate IUPAC Name: disodium; dodecanoate; 2-(1-hydroxyethylamino)-2-sulfobutanedioate Traditional Name: disodium; 2-(1-hydroxyethylamino)-2-sulfo-succinate; laurate Formula: C18H32NNa2O10S- MolecularWeight: 500.49192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)[O-].CC(NC(CC(=O)[O-])(C(=O)[O-])S(=O)(=O)O)O.[Na+].[Na+]

Isomeric SMILES

CCCCCCCCCCCC(=O)[O-].CC(NC(CC(=O)[O-])(C(=O)[O-])S(=O)(=O)O)O.[Na+].[Na+]

InChI

InChI=1S/C12H24O2.C6H11NO8S.2Na/c1-2-3-4-5-6-7-8-9-10-11-12(13)14;1-3(8)7-6(5(11)12,2-4(9)10)16(13,14)15;;/h2-11H2,1H3,(H,13,14);3,7-8H,2H2,1H3,(H,9,10)(H,11,12)(H,13,14,15);;/q;;2*+1/p-3