1,1-di(tetradecanoyloxy)propyl-(2-oxidanylbutan-2-yl)azanium bromide

Systemtic Name: 1,1-di(tetradecanoyloxy)propyl-(2-oxidanylbutan-2-yl)azanium bromide Openeye Name: 1,1-di(tetradecanoyloxy)propyl-(1-hydroxy-1-methyl-propyl)ammonium bromide CAS Name: 1,1-bis(1-oxotetradecoxy)propyl-(2-hydroxybutan-2-yl)ammonium bromide IUPAC Name: 1,1-di(tetradecanoyloxy)propyl-(2-hydroxybutan-2-yl)azanium bromide Traditional Name: 1,1-di(tetradecanoyloxy)propyl-(1-hydroxy-1-methyl-propyl)ammonium bromide Formula: C35H70BrNO5 MolecularWeight: 664.838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OC(CC)([NH2+]C(C)(CC)O)OC(=O)CCCCCCCCCCCCC.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OC(CC)([NH2+]C(C)(CC)O)OC(=O)CCCCCCCCCCCCC.[Br-]

InChI

InChI=1S/C35H69NO5.BrH/c1-6-10-12-14-16-18-20-22-24-26-28-30-32(37)40-35(9-4,36-34(5,39)8-3)41-33(38)31-29-27-25-23-21-19-17-15-13-11-7-2;/h36,39H,6-31H2,1-5H3;1H