(2-decoxy-2-oxidanylidene-ethyl)-dimethyl-(4-oxidanyl-4-phenyl-butyl)azanium chloride

Systemtic Name: (2-decoxy-2-oxidanylidene-ethyl)-dimethyl-(4-oxidanyl-4-phenyl-butyl)azanium chloride Openeye Name: (2-decoxy-2-oxo-ethyl)-(4-hydroxy-4-phenyl-butyl)-dimethyl-ammonium chloride CAS Name: (2-decoxy-2-oxoethyl)-(4-hydroxy-4-phenylbutyl)-dimethylammonium chloride IUPAC Name: (2-decoxy-2-oxoethyl)-(4-hydroxy-4-phenylbutyl)-dimethylazanium chloride Traditional Name: (2-decoxy-2-keto-ethyl)-(4-hydroxy-4-phenyl-butyl)-dimethyl-ammonium chloride Formula: C24H42ClNO3 MolecularWeight: 428.04818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(=O)C[N+](C)(C)CCCC(C1=CC=CC=C1)O.[Cl-]

Isomeric SMILES

CCCCCCCCCCOC(=O)C[N+](C)(C)CCCC(C1=CC=CC=C1)O.[Cl-]

InChI

InChI=1S/C24H42NO3.ClH/c1-4-5-6-7-8-9-10-14-20-28-24(27)21-25(2,3)19-15-18-23(26)22-16-12-11-13-17-22;/h11-13,16-17,23,26H,4-10,14-15,18-21H2,1-3H3;1H/q+1;/p-1