cerium(4+); hexadecyl(trimethyl)azanium; hexanitrate

Systemtic Name: cerium(4+); hexadecyl(trimethyl)azanium; hexanitrate Openeye Name: cerium(4+); hexadecyl(trimethyl)ammonium; hexanitrate CAS Name: cerium(4+); hexadecyl(trimethyl)ammonium; hexanitrate IUPAC Name: cerium(4+); hexadecyl(trimethyl)azanium; hexanitrate Traditional Name: cerium(4+); cetyl(trimethyl)ammonium; hexanitrate Formula: C38H84CeN8O18 MolecularWeight: 1081.23236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)C.CCCCCCCCCCCCCCCC[N+](C)(C)C.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Ce+4]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)C.CCCCCCCCCCCCCCCC[N+](C)(C)C.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Ce+4]

InChI

InChI=1S/2C19H42N.Ce.6NO3/c2*1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;;6*2-1(3)4/h2*5-19H2,1-4H3;;;;;;;/q2*+1;+4;6*-1