dimethyl-[2-(phenylcarbonyloxy)ethyl]-tetradecyl-azanium

Systemtic Name: dimethyl-[2-(phenylcarbonyloxy)ethyl]-tetradecyl-azanium Openeye Name: 2-benzoyloxyethyl-dimethyl-tetradecyl-ammonium CAS Name: 2-benzoyloxyethyl-dimethyl-tetradecylammonium IUPAC Name: 2-benzoyloxyethyl-dimethyl-tetradecylazanium Traditional Name: 2-benzoyloxyethyl-dimethyl-myristyl-ammonium Formula: C25H44NO2+ MolecularWeight: 390.62236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC[N+](C)(C)CCOC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCC[N+](C)(C)CCOC(=O)C1=CC=CC=C1

InChI

InChI=1S/C25H44NO2/c1-4-5-6-7-8-9-10-11-12-13-14-18-21-26(2,3)22-23-28-25(27)24-19-16-15-17-20-24/h15-17,19-20H,4-14,18,21-23H2,1-3H3/q+1