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

Systemtic Name: trimethyl-[(2R)-2-(3-methylbutanoyloxy)-4-oxidanylidene-4-tridecoxy-butyl]azanium Openeye Name: trimethyl-[(2R)-2-(3-methylbutanoyloxy)-4-oxo-4-tridecoxy-butyl]ammonium CAS Name: trimethyl-[(2R)-2-(3-methyl-1-oxobutoxy)-4-oxo-4-tridecoxybutyl]ammonium IUPAC Name: trimethyl-[(2R)-2-(3-methylbutanoyloxy)-4-oxo-4-tridecoxybutyl]azanium Traditional Name: [(2R)-2-isovaleryloxy-4-keto-4-tridecoxy-butyl]-trimethyl-ammonium Formula: C25H50NO4+ MolecularWeight: 428.6688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCCCCCCCCOC(=O)C[C@H](C[N+](C)(C)C)OC(=O)CC(C)C

InChI

InChI=1S/C25H50NO4/c1-7-8-9-10-11-12-13-14-15-16-17-18-29-24(27)20-23(21-26(4,5)6)30-25(28)19-22(2)3/h22-23H,7-21H2,1-6H3/q+1/t23-/m1/s1