dipotassium 2-dodecyl-2-(2-methylprop-2-enyl)-3-sulfo-butanedioate

Systemtic Name: dipotassium 2-dodecyl-2-(2-methylprop-2-enyl)-3-sulfo-butanedioate Openeye Name: dipotassium 2-dodecyl-2-(2-methylallyl)-3-sulfo-butanedioate CAS Name: dipotassium 2-dodecyl-2-(2-methylprop-2-enyl)-3-sulfobutanedioate IUPAC Name: dipotassium 2-dodecyl-2-(2-methylprop-2-enyl)-3-sulfobutanedioate Traditional Name: dipotassium 2-lauryl-2-(2-methylallyl)-3-sulfo-succinate Formula: C20H34K2O7S MolecularWeight: 496.74136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CC(=C)C)(C(C(=O)[O-])S(=O)(=O)O)C(=O)[O-].[K+].[K+]

Isomeric SMILES

CCCCCCCCCCCCC(CC(=C)C)(C(C(=O)[O-])S(=O)(=O)O)C(=O)[O-].[K+].[K+]

InChI

InChI=1S/C20H36O7S.2K/c1-4-5-6-7-8-9-10-11-12-13-14-20(19(23)24,15-16(2)3)17(18(21)22)28(25,26)27;;/h17H,2,4-15H2,1,3H3,(H,21,22)(H,23,24)(H,25,26,27);;/q;2*+1/p-2