[3-chloranyl-2-(phenylcarbonyloxy)propyl]-tripentyl-azanium

Systemtic Name: [3-chloranyl-2-(phenylcarbonyloxy)propyl]-tripentyl-azanium Openeye Name: (2-benzoyloxy-3-chloro-propyl)-tripentyl-ammonium CAS Name: (2-benzoyloxy-3-chloropropyl)-tripentylammonium IUPAC Name: (2-benzoyloxy-3-chloropropyl)-tripentylazanium Traditional Name: triamyl-(2-benzoyloxy-3-chloro-propyl)ammonium Formula: C25H43ClNO2+ MolecularWeight: 425.06742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[N+](CCCCC)(CCCCC)CC(CCl)OC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCC[N+](CCCCC)(CCCCC)CC(CCl)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C25H43ClNO2/c1-4-7-13-18-27(19-14-8-5-2,20-15-9-6-3)22-24(21-26)29-25(28)23-16-11-10-12-17-23/h10-12,16-17,24H,4-9,13-15,18-22H2,1-3H3/q+1