[1,1-diethoxy-2-(2-octylphenoxy)ethyl] hydrogen sulfate

Systemtic Name: [1,1-diethoxy-2-(2-octylphenoxy)ethyl] hydrogen sulfate Openeye Name: [1,1-diethoxy-2-(2-octylphenoxy)ethyl] hydrogen sulfate CAS Name: sulfuric acid [1,1-diethoxy-2-(2-octylphenoxy)ethyl] ester IUPAC Name: [1,1-diethoxy-2-(2-octylphenoxy)ethyl] hydrogen sulfate Traditional Name: sulfuric acid [1,1-diethoxy-2-(2-octylphenoxy)ethyl] ester Formula: C20H34O7S MolecularWeight: 418.54476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=CC=C1OCC(OCC)(OCC)OS(=O)(=O)O

Isomeric SMILES

CCCCCCCCC1=CC=CC=C1OCC(OCC)(OCC)OS(=O)(=O)O

InChI

InChI=1S/C20H34O7S/c1-4-7-8-9-10-11-14-18-15-12-13-16-19(18)24-17-20(25-5-2,26-6-3)27-28(21,22)23/h12-13,15-16H,4-11,14,17H2,1-3H3,(H,21,22,23)