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dimethyl-[(2-octadecylphenyl)methyl]azanium; tetrakis(chloranyl)iron

dimethyl-[(2-octadecylphenyl)methyl]azanium; tetrakis(chloranyl)iron

Systemtic Name:dimethyl-[(2-octadecylphenyl)methyl]azanium; tetrakis(chloranyl)iron
Openeye Name:dimethyl-[(2-octadecylphenyl)methyl]ammonium; tetrachloroiron
CAS Name:dimethyl-[(2-octadecylphenyl)methyl]ammonium; tetrachloroiron
IUPAC Name:dimethyl-[(2-octadecylphenyl)methyl]azanium; tetrachloroiron
Traditional Name:dimethyl-(2-stearylbenzyl)ammonium; tetrachloroiron
Formula: C27H50Cl4FeN+
MolecularWeight: 586.3496
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=CC=CC=C1C[NH+](C)C.Cl[Fe](Cl)(Cl)Cl


Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=CC=CC=C1C[NH+](C)C.Cl[Fe](Cl)(Cl)Cl


InChI

InChI=1S/C27H49N.4ClH.Fe/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-26-23-20-21-24-27(26)25-28(2)3;;;;;/h20-21,23-24H,4-19,22,25H2,1-3H3;4*1H;/q;;;;;+4/p-3


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