[2,2-dimethyl-3-(octanoylamino)propyl]-dimethyl-(phenylmethyl)azanium

Systemtic Name: [2,2-dimethyl-3-(octanoylamino)propyl]-dimethyl-(phenylmethyl)azanium Openeye Name: benzyl-[2,2-dimethyl-3-(octanoylamino)propyl]-dimethyl-ammonium CAS Name: [2,2-dimethyl-3-(1-oxooctylamino)propyl]-dimethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2,2-dimethyl-3-(octanoylamino)propyl]-dimethylazanium Traditional Name: benzyl-[3-(caprylylamino)-2,2-dimethyl-propyl]-dimethyl-ammonium Formula: C22H39N2O+ MolecularWeight: 347.55786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NCC(C)(C)C[N+](C)(C)CC1=CC=CC=C1

Isomeric SMILES

CCCCCCCC(=O)NCC(C)(C)C[N+](C)(C)CC1=CC=CC=C1

InChI

InChI=1S/C22H38N2O/c1-6-7-8-9-13-16-21(25)23-18-22(2,3)19-24(4,5)17-20-14-11-10-12-15-20/h10-12,14-15H,6-9,13,16-19H2,1-5H3/p+1