sodium octan-3-yl octyl sulfate

Systemtic Name: sodium octan-3-yl octyl sulfate Openeye Name: sodium 1-ethylhexyl octyl sulfate CAS Name: sodium sulfuric acid octan-3-yl octyl ester IUPAC Name: sodium octan-3-yl octyl sulfate Traditional Name: sodium sulfuric acid 1-ethylhexyl octyl ester Formula: C16H34NaO4S+ MolecularWeight: 345.49353

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOS(=O)(=O)OC(CC)CCCCC.[Na+]

Isomeric SMILES

CCCCCCCCOS(=O)(=O)OC(CC)CCCCC.[Na+]

InChI

InChI=1S/C16H34O4S.Na/c1-4-7-9-10-11-13-15-19-21(17,18)20-16(6-3)14-12-8-5-2;/h16H,4-15H2,1-3H3;/q;+1