tripentyl-[2-(phenylcarbonyloxy)propyl]azanium chloride

Systemtic Name: tripentyl-[2-(phenylcarbonyloxy)propyl]azanium chloride Openeye Name: 2-benzoyloxypropyl(tripentyl)ammonium chloride CAS Name: 2-benzoyloxypropyl(tripentyl)ammonium chloride IUPAC Name: 2-benzoyloxypropyl(tripentyl)azanium chloride Traditional Name: triamyl(2-benzoyloxypropyl)ammonium chloride Formula: C25H44ClNO2 MolecularWeight: 426.07536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+](CCCCC)(CCCCC)CC(C)OC(=O)C1=CC=CC=C1.[Cl-]

Isomeric SMILES

CCCCC[N+](CCCCC)(CCCCC)CC(C)OC(=O)C1=CC=CC=C1.[Cl-]

InChI

InChI=1S/C25H44NO2.ClH/c1-5-8-14-19-26(20-15-9-6-2,21-16-10-7-3)22-23(4)28-25(27)24-17-12-11-13-18-24;/h11-13,17-18,23H,5-10,14-16,19-22H2,1-4H3;1H/q+1;/p-1