trimethyl-[(2R)-2-nonanoyloxy-4-oxidanylidene-4-tridecoxy-butyl]azanium chloride

Systemtic Name: trimethyl-[(2R)-2-nonanoyloxy-4-oxidanylidene-4-tridecoxy-butyl]azanium chloride Openeye Name: trimethyl-[(2R)-2-nonanoyloxy-4-oxo-4-tridecoxy-butyl]ammonium chloride CAS Name: trimethyl-[(2R)-4-oxo-2-(1-oxononoxy)-4-tridecoxybutyl]ammonium chloride IUPAC Name: trimethyl-[(2R)-2-nonanoyloxy-4-oxo-4-tridecoxybutyl]azanium chloride Traditional Name: [(2R)-4-keto-2-pelargonyloxy-4-tridecoxy-butyl]-trimethyl-ammonium chloride Formula: C29H58ClNO4 MolecularWeight: 520.22812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOC(=O)CC(C[N+](C)(C)C)OC(=O)CCCCCCCC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCOC(=O)C[C@H](C[N+](C)(C)C)OC(=O)CCCCCCCC.[Cl-]

InChI

InChI=1S/C29H58NO4.ClH/c1-6-8-10-12-14-15-16-17-18-20-22-24-33-29(32)25-27(26-30(3,4)5)34-28(31)23-21-19-13-11-9-7-2;/h27H,6-26H2,1-5H3;1H/q+1;/p-1/t27-;/m1./s1