sodium; hexadecan-1-olate; 3-hexadecoxy-2-methyl-butan-1-ol; hydride

Systemtic Name: sodium; hexadecan-1-olate; 3-hexadecoxy-2-methyl-butan-1-ol; hydride Openeye Name: sodium; hexadecan-1-olate; 3-hexadecoxy-2-methyl-butan-1-ol; hydride CAS Name: sodium; 1-hexadecanolate; 3-hexadecoxy-2-methyl-1-butanol; hydride IUPAC Name: sodium; hexadecan-1-olate; 3-hexadecoxy-2-methylbutan-1-ol; hydride Traditional Name: sodium; 3-cetyloxy-2-methyl-butan-1-ol; hexadecan-1-olate; hydride Formula: C37H78NaO3- MolecularWeight: 594.00319

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Descriptors Computed from Structure

Canonical SMILES:

[H-].CCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCCOC(C)C(C)CO.[Na+]

Isomeric SMILES

[H-].CCCCCCCCCCCCCCCC[O-].CCCCCCCCCCCCCCCCOC(C)C(C)CO.[Na+]

InChI

InChI=1S/C21H44O2.C16H33O.Na.H/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-21(3)20(2)19-22;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17;;/h20-22H,4-19H2,1-3H3;2-16H2,1H3;;/q;-1;+1;-1