sodium (E)-4-oxidanylhept-2-enoate

Systemtic Name: sodium (E)-4-oxidanylhept-2-enoate Openeye Name: sodium (E)-4-hydroxyhept-2-enoate CAS Name: sodium (E)-4-hydroxy-2-heptenoate IUPAC Name: sodium (E)-4-hydroxyhept-2-enoate Traditional Name: sodium (E)-4-hydroxyhept-2-enoate Formula: C7H11NaO3 MolecularWeight: 166.15021

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCC(/C=C/C(=O)[O-])O.[Na+]

InChI

InChI=1S/C7H12O3.Na/c1-2-3-6(8)4-5-7(9)10;/h4-6,8H,2-3H2,1H3,(H,9,10);/q;+1/p-1/b5-4+;