trimethyl-[2-(3-methylbutanoyloxy)-4-oxidanylidene-4-undecoxy-butyl]azanium

Systemtic Name: trimethyl-[2-(3-methylbutanoyloxy)-4-oxidanylidene-4-undecoxy-butyl]azanium Openeye Name: trimethyl-[2-(3-methylbutanoyloxy)-4-oxo-4-undecoxy-butyl]ammonium CAS Name: trimethyl-[2-(3-methyl-1-oxobutoxy)-4-oxo-4-undecoxybutyl]ammonium IUPAC Name: trimethyl-[2-(3-methylbutanoyloxy)-4-oxo-4-undecoxybutyl]azanium Traditional Name: (2-isovaleryloxy-4-keto-4-undecoxy-butyl)-trimethyl-ammonium Formula: C23H46NO4+ MolecularWeight: 400.61564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC(=O)CC(C[N+](C)(C)C)OC(=O)CC(C)C

Isomeric SMILES

CCCCCCCCCCCOC(=O)CC(C[N+](C)(C)C)OC(=O)CC(C)C

InChI

InChI=1S/C23H46NO4/c1-7-8-9-10-11-12-13-14-15-16-27-22(25)18-21(19-24(4,5)6)28-23(26)17-20(2)3/h20-21H,7-19H2,1-6H3/q+1