(4-phenyl-4-propyl-dodecan-5-yl)azanium chloride

Systemtic Name: (4-phenyl-4-propyl-dodecan-5-yl)azanium chloride Openeye Name: 1-(1-phenyl-1-propyl-butyl)octylammonium chloride CAS Name: (4-phenyl-4-propyldodecan-5-yl)ammonium chloride IUPAC Name: (4-phenyl-4-propyldodecan-5-yl)azanium chloride Traditional Name: 1-(1-phenyl-1-propyl-butyl)octylammonium chloride Formula: C21H38ClN MolecularWeight: 339.98612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C(CCC)(CCC)C1=CC=CC=C1)[NH3+].[Cl-]

Isomeric SMILES

CCCCCCCC(C(CCC)(CCC)C1=CC=CC=C1)[NH3+].[Cl-]

InChI

InChI=1S/C21H37N.ClH/c1-4-7-8-9-13-16-20(22)21(17-5-2,18-6-3)19-14-11-10-12-15-19;/h10-12,14-15,20H,4-9,13,16-18,22H2,1-3H3;1H