10,11-di(nonyl)heptacosan-10-ylazanium chloride

Systemtic Name: 10,11-di(nonyl)heptacosan-10-ylazanium chloride Openeye Name: 1,1,2-tri(nonyl)octadecylammonium chloride CAS Name: 10,11-di(nonyl)heptacosan-10-ylammonium chloride IUPAC Name: 10,11-di(nonyl)heptacosan-10-ylazanium chloride Traditional Name: 1,1,2-tri(nonyl)octadecylammonium chloride Formula: C45H94ClN MolecularWeight: 684.68756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CCCCCCCCC)C(CCCCCCCCC)(CCCCCCCCC)[NH3+].[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CCCCCCCCC)C(CCCCCCCCC)(CCCCCCCCC)[NH3+].[Cl-]

InChI

InChI=1S/C45H93N.ClH/c1-5-9-13-17-21-22-23-24-25-26-27-29-33-37-41-44(40-36-32-28-18-14-10-6-2)45(46,42-38-34-30-19-15-11-7-3)43-39-35-31-20-16-12-8-4;/h44H,5-43,46H2,1-4H3;1H