potassium; 4-carboxypent-4-ene-1-sulfonate; 2-methylidenehexanoic acid; 2-methylprop-2-enoic acid

Systemtic Name: potassium; 4-carboxypent-4-ene-1-sulfonate; 2-methylidenehexanoic acid; 2-methylprop-2-enoic acid Openeye Name: potassium; 4-carboxypent-4-ene-1-sulfonate; 2-methylenehexanoic acid; 2-methylprop-2-enoic acid CAS Name: potassium; 4-carboxy-4-pentene-1-sulfonate; 2-methylenehexanoic acid; 2-methyl-2-propenoic acid IUPAC Name: potassium; 4-carboxypent-4-ene-1-sulfonate; 2-methylidenehexanoic acid; 2-methylprop-2-enoic acid Traditional Name: potassium; 2-butylacrylic acid; 4-carboxypent-4-ene-1-sulfonate; methacrylic acid Formula: C17H27KO9S MolecularWeight: 446.55418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H12O2.C6H10O5S.C4H6O2.K/c1-3-4-5-6(2)7(8)9;1-5(6(7)8)3-2-4-12(9,10)11;1-3(2)4(5)6;/h2-5H2,1H3,(H,8,9);1-4H2,(H,7,8)(H,9,10,11);1H2,2H3,(H,5,6);/q;;;+1/p-1