trimethyl-[(2R)-2-octadecanoyloxy-4-oxidanylidene-4-tetradecoxy-butyl]azanium chloride

Systemtic Name: trimethyl-[(2R)-2-octadecanoyloxy-4-oxidanylidene-4-tetradecoxy-butyl]azanium chloride Openeye Name: trimethyl-[(2R)-2-octadecanoyloxy-4-oxo-4-tetradecoxy-butyl]ammonium chloride CAS Name: trimethyl-[(2R)-4-oxo-2-(1-oxooctadecoxy)-4-tetradecoxybutyl]ammonium chloride IUPAC Name: trimethyl-[(2R)-2-octadecanoyloxy-4-oxo-4-tetradecoxybutyl]azanium chloride Traditional Name: [(2R)-4-keto-4-myristyloxy-2-stearoyloxy-butyl]-trimethyl-ammonium chloride Formula: C39H78ClNO4 MolecularWeight: 660.49392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(CC(=O)OCCCCCCCCCCCCCC)C[N+](C)(C)C.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)O[C@H](CC(=O)OCCCCCCCCCCCCCC)C[N+](C)(C)C.[Cl-]

InChI

InChI=1S/C39H78NO4.ClH/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-38(41)44-37(36-40(3,4)5)35-39(42)43-34-32-30-28-26-24-19-17-15-13-11-9-7-2;/h37H,6-36H2,1-5H3;1H/q+1;/p-1/t37-;/m1./s1