(2-oxidanyl-3-tetradecoxy-butan-2-yl)-propyl-tetradecoxy-azanium bromide

Systemtic Name: (2-oxidanyl-3-tetradecoxy-butan-2-yl)-propyl-tetradecoxy-azanium bromide Openeye Name: (1-hydroxy-1-methyl-2-tetradecoxy-propyl)-propyl-tetradecoxy-ammonium bromide CAS Name: (2-hydroxy-3-tetradecoxybutan-2-yl)-propyl-tetradecoxyammonium bromide IUPAC Name: (2-hydroxy-3-tetradecoxybutan-2-yl)-propyl-tetradecoxyazanium bromide Traditional Name: (1-hydroxy-1-methyl-2-myristyloxy-propyl)-myristyloxy-propyl-ammonium bromide Formula: C35H74BrNO3 MolecularWeight: 636.87096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC(C)C(C)([NH+](CCC)OCCCCCCCCCCCCCC)O.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCOC(C)C(C)([NH+](CCC)OCCCCCCCCCCCCCC)O.[Br-]

InChI

InChI=1S/C35H73NO3.BrH/c1-6-9-11-13-15-17-19-21-23-25-27-29-32-38-34(4)35(5,37)36(31-8-3)39-33-30-28-26-24-22-20-18-16-14-12-10-7-2;/h34,37H,6-33H2,1-5H3;1H