trimethyl-(4-oxidanylidene-2-pentanoyloxy-4-tridecoxy-butyl)azanium

Systemtic Name: trimethyl-(4-oxidanylidene-2-pentanoyloxy-4-tridecoxy-butyl)azanium Openeye Name: trimethyl-(4-oxo-2-pentanoyloxy-4-tridecoxy-butyl)ammonium CAS Name: trimethyl-[4-oxo-2-(1-oxopentoxy)-4-tridecoxybutyl]ammonium IUPAC Name: trimethyl-(4-oxo-2-pentanoyloxy-4-tridecoxybutyl)azanium Traditional Name: (4-keto-4-tridecoxy-2-valeryloxy-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)CCCC

Isomeric SMILES

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

InChI

InChI=1S/C25H50NO4/c1-6-8-10-11-12-13-14-15-16-17-18-20-29-25(28)21-23(22-26(3,4)5)30-24(27)19-9-7-2/h23H,6-22H2,1-5H3/q+1