(3-chloranyl-2-oxidanyl-propyl)-hexadecyl-dimethyl-azanium

Systemtic Name: (3-chloranyl-2-oxidanyl-propyl)-hexadecyl-dimethyl-azanium Openeye Name: (3-chloro-2-hydroxy-propyl)-hexadecyl-dimethyl-ammonium CAS Name: (3-chloro-2-hydroxypropyl)-hexadecyl-dimethylammonium IUPAC Name: (3-chloro-2-hydroxypropyl)-hexadecyl-dimethylazanium Traditional Name: cetyl-(3-chloro-2-hydroxy-propyl)-dimethyl-ammonium Formula: C21H45ClNO+ MolecularWeight: 363.0411

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CC(CCl)O

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CC(CCl)O

InChI

InChI=1S/C21H45ClNO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(2,3)20-21(24)19-22/h21,24H,4-20H2,1-3H3/q+1