[1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]-dihexadecyl-methyl-azanium

Systemtic Name: [1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]-dihexadecyl-methyl-azanium Openeye Name: dihexadecyl-[2-methoxy-1,1-bis(methoxymethyl)ethyl]-methyl-ammonium CAS Name: [1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]-dihexadecyl-methylammonium IUPAC Name: [1,3-dimethoxy-2-(methoxymethyl)propan-2-yl]-dihexadecyl-methylazanium Traditional Name: dicetyl-[2-methoxy-1,1-bis(methoxymethyl)ethyl]-methyl-ammonium Formula: C40H84NO3+ MolecularWeight: 627.09986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(CCCCCCCCCCCCCCCC)C(COC)(COC)COC

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(CCCCCCCCCCCCCCCC)C(COC)(COC)COC

InChI

InChI=1S/C40H84NO3/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-41(3,40(37-42-4,38-43-5)39-44-6)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-2/h7-39H2,1-6H3/q+1