2-[3,4-bis(chloranyl)-2-tetradecyl-phenyl]propan-2-ylazanium chloride

Systemtic Name: 2-[3,4-bis(chloranyl)-2-tetradecyl-phenyl]propan-2-ylazanium chloride Openeye Name: [1-(3,4-dichloro-2-tetradecyl-phenyl)-1-methyl-ethyl]ammonium chloride CAS Name: 2-(3,4-dichloro-2-tetradecylphenyl)propan-2-ylammonium chloride IUPAC Name: 2-(3,4-dichloro-2-tetradecylphenyl)propan-2-ylazanium chloride Traditional Name: [1-(3,4-dichloro-2-myristyl-phenyl)-1-methyl-ethyl]ammonium chloride Formula: C23H40Cl3N MolecularWeight: 436.9294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC1=C(C=CC(=C1Cl)Cl)C(C)(C)[NH3+].[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCC1=C(C=CC(=C1Cl)Cl)C(C)(C)[NH3+].[Cl-]

InChI

InChI=1S/C23H39Cl2N.ClH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-20(23(2,3)26)17-18-21(24)22(19)25;/h17-18H,4-16,26H2,1-3H3;1H