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

Systemtic Name: 2-methylundecan-2-yl(1-phenylprop-2-enyl)azanium chloride Openeye Name: 1,1-dimethyldecyl(1-phenylallyl)ammonium chloride CAS Name: 2-methylundecan-2-yl(1-phenylprop-2-enyl)ammonium chloride IUPAC Name: 2-methylundecan-2-yl(1-phenylprop-2-enyl)azanium chloride Traditional Name: 1,1-dimethyldecyl(1-phenylallyl)ammonium chloride Formula: C21H36ClN MolecularWeight: 337.97024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H35N.ClH/c1-5-7-8-9-10-11-15-18-21(3,4)22-20(6-2)19-16-13-12-14-17-19;/h6,12-14,16-17,20,22H,2,5,7-11,15,18H2,1,3-4H3;1H