sodium 4-(hydroxymethyl)-3-methyl-3-oxidanyl-pent-4-enoate

Systemtic Name: sodium 4-(hydroxymethyl)-3-methyl-3-oxidanyl-pent-4-enoate Openeye Name: sodium 3-hydroxy-4-(hydroxymethyl)-3-methyl-pent-4-enoate CAS Name: sodium 3-hydroxy-4-(hydroxymethyl)-3-methyl-4-pentenoate IUPAC Name: sodium 3-hydroxy-4-(hydroxymethyl)-3-methylpent-4-enoate Traditional Name: sodium 3-hydroxy-3-methyl-4-methylol-pent-4-enoate Formula: C7H11NaO4 MolecularWeight: 182.14961

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)[O-])(C(=C)CO)O.[Na+]

Isomeric SMILES

CC(CC(=O)[O-])(C(=C)CO)O.[Na+]

InChI

InChI=1S/C7H12O4.Na/c1-5(4-8)7(2,11)3-6(9)10;/h8,11H,1,3-4H2,2H3,(H,9,10);/q;+1/p-1