1,4-dihexadecyl-1,4-dimethyl-1,4-diazepane-1,4-diium

Systemtic Name: 1,4-dihexadecyl-1,4-dimethyl-1,4-diazepane-1,4-diium Openeye Name: 1,4-dihexadecyl-1,4-dimethyl-1,4-diazepane-1,4-diium CAS Name: 1,4-dihexadecyl-1,4-dimethyl-1,4-diazepane-1,4-diium IUPAC Name: 1,4-dihexadecyl-1,4-dimethyl-1,4-diazepane-1,4-diium Traditional Name: 1,4-dicetyl-1,4-dimethyl-1,4-diazepane-1,4-diium Formula: C39H82N2+2 MolecularWeight: 579.08178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+]1(CCC[N+](CC1)(C)CCCCCCCCCCCCCCCC)C

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+]1(CCC[N+](CC1)(C)CCCCCCCCCCCCCCCC)C

InChI

InChI=1S/C39H82N2/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-34-40(3)36-33-37-41(4,39-38-40)35-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h5-39H2,1-4H3/q+2