sodium 2-hexadecoxy-2-oxidanylidene-ethanesulfonic acid

Systemtic Name: sodium 2-hexadecoxy-2-oxidanylidene-ethanesulfonic acid Openeye Name: sodium 2-hexadecoxy-2-oxo-ethanesulfonic acid CAS Name: sodium 2-hexadecoxy-2-oxoethanesulfonic acid IUPAC Name: sodium 2-hexadecoxy-2-oxoethanesulfonic acid Traditional Name: sodium 2-cetyloxy-2-keto-ethanesulfonic acid Formula: C18H36NaO5S+ MolecularWeight: 387.53021

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)CS(=O)(=O)O.[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)CS(=O)(=O)O.[Na+]

InChI

InChI=1S/C18H36O5S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-18(19)17-24(20,21)22;/h2-17H2,1H3,(H,20,21,22);/q;+1