4-(3-hexadecoxy-2-methoxy-propoxy)butyl-dimethyl-(3-oxidanylpropyl)azanium

Systemtic Name: 4-(3-hexadecoxy-2-methoxy-propoxy)butyl-dimethyl-(3-oxidanylpropyl)azanium Openeye Name: 4-(3-hexadecoxy-2-methoxy-propoxy)butyl-(3-hydroxypropyl)-dimethyl-ammonium CAS Name: 4-(3-hexadecoxy-2-methoxypropoxy)butyl-(3-hydroxypropyl)-dimethylammonium IUPAC Name: 4-(3-hexadecoxy-2-methoxypropoxy)butyl-(3-hydroxypropyl)-dimethylazanium Traditional Name: 4-(3-cetyloxy-2-methoxy-propoxy)butyl-(3-hydroxypropyl)-dimethyl-ammonium Formula: C29H62NO4+ MolecularWeight: 488.80688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(COCCCC[N+](C)(C)CCCO)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(COCCCC[N+](C)(C)CCCO)OC

InChI

InChI=1S/C29H62NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-19-25-33-27-29(32-4)28-34-26-20-18-22-30(2,3)23-21-24-31/h29,31H,5-28H2,1-4H3/q+1