3-(3-acetyloxy-4-hexadecoxy-butyl)sulfanylpropyl-trimethyl-azanium

Systemtic Name: 3-(3-acetyloxy-4-hexadecoxy-butyl)sulfanylpropyl-trimethyl-azanium Openeye Name: 3-(3-acetoxy-4-hexadecoxy-butyl)sulfanylpropyl-trimethyl-ammonium CAS Name: 3-[(3-acetyloxy-4-hexadecoxybutyl)thio]propyl-trimethylammonium IUPAC Name: 3-(3-acetyloxy-4-hexadecoxybutyl)sulfanylpropyl-trimethylazanium Traditional Name: 3-[(3-acetoxy-4-cetyloxy-butyl)thio]propyl-trimethyl-ammonium Formula: C28H58NO3S+ MolecularWeight: 488.83002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(CCSCCC[N+](C)(C)C)OC(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(CCSCCC[N+](C)(C)C)OC(=O)C

InChI

InChI=1S/C28H58NO3S/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-31-26-28(32-27(2)30)21-25-33-24-20-22-29(3,4)5/h28H,6-26H2,1-5H3/q+1