sodium; benzenesulfonate; dodecanoate

Systemtic Name: sodium; benzenesulfonate; dodecanoate Openeye Name: sodium; benzenesulfonate; dodecanoate CAS Name: sodium; benzenesulfonate; dodecanoate IUPAC Name: sodium; benzenesulfonate; dodecanoate Traditional Name: sodium laurate besylate Formula: C18H28NaO5S- MolecularWeight: 379.46669

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)[O-].C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCC(=O)[O-].C1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C12H24O2.C6H6O3S.Na/c1-2-3-4-5-6-7-8-9-10-11-12(13)14;7-10(8,9)6-4-2-1-3-5-6;/h2-11H2,1H3,(H,13,14);1-5H,(H,7,8,9);/q;;+1/p-2