[3-[(2,4-dichlorophenyl)methyl]-2-methyl-tridecan-2-yl]azanium chloride

Systemtic Name: [3-[(2,4-dichlorophenyl)methyl]-2-methyl-tridecan-2-yl]azanium chloride Openeye Name: [2-[(2,4-dichlorophenyl)methyl]-1,1-dimethyl-dodecyl]ammonium chloride CAS Name: [3-[(2,4-dichlorophenyl)methyl]-2-methyltridecan-2-yl]ammonium chloride IUPAC Name: [3-[(2,4-dichlorophenyl)methyl]-2-methyltridecan-2-yl]azanium chloride Traditional Name: [2-(2,4-dichlorobenzyl)-1,1-dimethyl-dodecyl]ammonium chloride Formula: C21H36Cl3N MolecularWeight: 408.87624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CC1=C(C=C(C=C1)Cl)Cl)C(C)(C)[NH3+].[Cl-]

Isomeric SMILES

CCCCCCCCCCC(CC1=C(C=C(C=C1)Cl)Cl)C(C)(C)[NH3+].[Cl-]

InChI

InChI=1S/C21H35Cl2N.ClH/c1-4-5-6-7-8-9-10-11-12-18(21(2,3)24)15-17-13-14-19(22)16-20(17)23;/h13-14,16,18H,4-12,15,24H2,1-3H3;1H