dimethyl-(2-oxidanyl-3-phenoxy-propyl)-tetradecyl-azanium chloride

Systemtic Name: dimethyl-(2-oxidanyl-3-phenoxy-propyl)-tetradecyl-azanium chloride Openeye Name: (2-hydroxy-3-phenoxy-propyl)-dimethyl-tetradecyl-ammonium chloride CAS Name: (2-hydroxy-3-phenoxypropyl)-dimethyl-tetradecylammonium chloride IUPAC Name: (2-hydroxy-3-phenoxypropyl)-dimethyl-tetradecylazanium chloride Traditional Name: (2-hydroxy-3-phenoxy-propyl)-dimethyl-myristyl-ammonium chloride Formula: C25H46ClNO2 MolecularWeight: 428.09124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC[N+](C)(C)CC(COC1=CC=CC=C1)O.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCC[N+](C)(C)CC(COC1=CC=CC=C1)O.[Cl-]

InChI

InChI=1S/C25H46NO2.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-18-21-26(2,3)22-24(27)23-28-25-19-16-15-17-20-25;/h15-17,19-20,24,27H,4-14,18,21-23H2,1-3H3;1H/q+1;/p-1