dipotassium 2-(1,7-disulfoheptan-4-ylidene)butanedioate

Systemtic Name: dipotassium 2-(1,7-disulfoheptan-4-ylidene)butanedioate Openeye Name: dipotassium 2-[4-sulfo-1-(3-sulfopropyl)butylidene]butanedioate CAS Name: dipotassium 2-(1,7-disulfoheptan-4-ylidene)butanedioate IUPAC Name: dipotassium 2-(1,7-disulfoheptan-4-ylidene)butanedioate Traditional Name: dipotassium 2-[4-sulfo-1-(3-sulfopropyl)butylidene]succinate Formula: C11H16K2O10S2 MolecularWeight: 450.56534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CC(=C(CC(=O)[O-])C(=O)[O-])CCCS(=O)(=O)O)CS(=O)(=O)O.[K+].[K+]

Isomeric SMILES

C(CC(=C(CC(=O)[O-])C(=O)[O-])CCCS(=O)(=O)O)CS(=O)(=O)O.[K+].[K+]

InChI

InChI=1S/C11H18O10S2.2K/c12-10(13)7-9(11(14)15)8(3-1-5-22(16,17)18)4-2-6-23(19,20)21;;/h1-7H2,(H,12,13)(H,14,15)(H,16,17,18)(H,19,20,21);;/q;2*+1/p-2