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4-chloranyl-2-cyclohexyl-phenolate; ethyl-hexadecyl-dimethyl-azanium

4-chloranyl-2-cyclohexyl-phenolate; ethyl-hexadecyl-dimethyl-azanium

Systemtic Name:4-chloranyl-2-cyclohexyl-phenolate; ethyl-hexadecyl-dimethyl-azanium
Openeye Name:4-chloro-2-cyclohexyl-phenolate; ethyl-hexadecyl-dimethyl-ammonium
CAS Name:4-chloro-2-cyclohexylphenolate; ethyl-hexadecyl-dimethylammonium
IUPAC Name:4-chloro-2-cyclohexylphenolate; ethyl-hexadecyl-dimethylazanium
Traditional Name:cetyl-ethyl-dimethyl-ammonium; 4-chloro-2-cyclohexyl-phenolate
Formula: C32H58ClNO
MolecularWeight: 508.26202
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)CC.C1CCC(CC1)C2=C(C=CC(=C2)Cl)[O-]


Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)CC.C1CCC(CC1)C2=C(C=CC(=C2)Cl)[O-]


InChI

InChI=1S/C20H44N.C12H15ClO/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(3,4)6-2;13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h5-20H2,1-4H3;6-9,14H,1-5H2/q+1;/p-1


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