sodium 2-(2-octylphenoxy)ethyl hydrogen sulfate

Systemtic Name: sodium 2-(2-octylphenoxy)ethyl hydrogen sulfate Openeye Name: sodium 2-(2-octylphenoxy)ethyl hydrogen sulfate CAS Name: sodium sulfuric acid 2-(2-octylphenoxy)ethyl ester IUPAC Name: sodium 2-(2-octylphenoxy)ethyl hydrogen sulfate Traditional Name: sodium sulfuric acid 2-(2-octylphenoxy)ethyl ester Formula: C16H26NaO5S+ MolecularWeight: 353.42941

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=CC=C1OCCOS(=O)(=O)O.[Na+]

Isomeric SMILES

CCCCCCCCC1=CC=CC=C1OCCOS(=O)(=O)O.[Na+]

InChI

InChI=1S/C16H26O5S.Na/c1-2-3-4-5-6-7-10-15-11-8-9-12-16(15)20-13-14-21-22(17,18)19;/h8-9,11-12H,2-7,10,13-14H2,1H3,(H,17,18,19);/q;+1