dodecyl-(phenylmethyl)-(2-phenylpropan-2-yl)azanium chloride

Systemtic Name: dodecyl-(phenylmethyl)-(2-phenylpropan-2-yl)azanium chloride Openeye Name: benzyl-dodecyl-(1-methyl-1-phenyl-ethyl)ammonium chloride CAS Name: dodecyl-(phenylmethyl)-(2-phenylpropan-2-yl)ammonium chloride IUPAC Name: benzyl-dodecyl-(2-phenylpropan-2-yl)azanium chloride Traditional Name: benzyl-cumyl-lauryl-ammonium chloride Formula: C28H44ClN MolecularWeight: 430.10866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[NH+](CC1=CC=CC=C1)C(C)(C)C2=CC=CC=C2.[Cl-]

Isomeric SMILES

CCCCCCCCCCCC[NH+](CC1=CC=CC=C1)C(C)(C)C2=CC=CC=C2.[Cl-]

InChI

InChI=1S/C28H43N.ClH/c1-4-5-6-7-8-9-10-11-12-19-24-29(25-26-20-15-13-16-21-26)28(2,3)27-22-17-14-18-23-27;/h13-18,20-23H,4-12,19,24-25H2,1-3H3;1H