3-(dodecanoylamino)propyl-dimethyl-(2-oxidanylidene-2-phenethyloxy-ethyl)azanium

Systemtic Name: 3-(dodecanoylamino)propyl-dimethyl-(2-oxidanylidene-2-phenethyloxy-ethyl)azanium Openeye Name: 3-(dodecanoylamino)propyl-dimethyl-(2-oxo-2-phenethyloxy-ethyl)ammonium CAS Name: dimethyl-[3-(1-oxododecylamino)propyl]-(2-oxo-2-phenethyloxyethyl)ammonium IUPAC Name: 3-(dodecanoylamino)propyl-dimethyl-(2-oxo-2-phenethyloxyethyl)azanium Traditional Name: (2-keto-2-phenethyloxy-ethyl)-[3-(lauroylamino)propyl]-dimethyl-ammonium Formula: C27H47N2O3+ MolecularWeight: 447.67368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(=O)OCCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(=O)OCCC1=CC=CC=C1

InChI

InChI=1S/C27H46N2O3/c1-4-5-6-7-8-9-10-11-15-19-26(30)28-21-16-22-29(2,3)24-27(31)32-23-20-25-17-13-12-14-18-25/h12-14,17-18H,4-11,15-16,19-24H2,1-3H3/p+1