sodium 4-oxidanylcycloicosane-1-carboxylate

Systemtic Name: sodium 4-oxidanylcycloicosane-1-carboxylate Openeye Name: sodium 4-hydroxycycloicosanecarboxylate CAS Name: sodium 4-hydroxy-1-cycloeicosanecarboxylate IUPAC Name: sodium 4-hydroxycycloicosane-1-carboxylate Traditional Name: sodium 4-hydroxycycloeicosanecarboxylate Formula: C21H39NaO3 MolecularWeight: 362.52233

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCCCCC(CCC(CCCCCCC1)C(=O)[O-])O.[Na+]

Isomeric SMILES

C1CCCCCCCCC(CCC(CCCCCCC1)C(=O)[O-])O.[Na+]

InChI

InChI=1S/C21H40O3.Na/c22-20-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-19(17-18-20)21(23)24;/h19-20,22H,1-18H2,(H,23,24);/q;+1/p-1