2-methylnonadecan-2-yl(1-phenylprop-2-enyl)azanium chloride

Systemtic Name: 2-methylnonadecan-2-yl(1-phenylprop-2-enyl)azanium chloride Openeye Name: 1,1-dimethyloctadecyl(1-phenylallyl)ammonium chloride CAS Name: 2-methylnonadecan-2-yl(1-phenylprop-2-enyl)ammonium chloride IUPAC Name: 2-methylnonadecan-2-yl(1-phenylprop-2-enyl)azanium chloride Traditional Name: 1,1-dimethyloctadecyl(1-phenylallyl)ammonium chloride Formula: C29H52ClN MolecularWeight: 450.18288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(C)(C)[NH2+]C(C=C)C1=CC=CC=C1.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(C)(C)[NH2+]C(C=C)C1=CC=CC=C1.[Cl-]

InChI

InChI=1S/C29H51N.ClH/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-23-26-29(3,4)30-28(6-2)27-24-21-20-22-25-27;/h6,20-22,24-25,28,30H,2,5,7-19,23,26H2,1,3-4H3;1H