4-(2-propylphenyl)heptan-4-ylazanium chloride

Systemtic Name: 4-(2-propylphenyl)heptan-4-ylazanium chloride Openeye Name: [1-propyl-1-(2-propylphenyl)butyl]ammonium chloride CAS Name: 4-(2-propylphenyl)heptan-4-ylammonium chloride IUPAC Name: 4-(2-propylphenyl)heptan-4-ylazanium chloride Traditional Name: [1-propyl-1-(2-propylphenyl)butyl]ammonium chloride Formula: C16H28ClN MolecularWeight: 269.85322

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC=C1C(CCC)(CCC)[NH3+].[Cl-]

Isomeric SMILES

CCCC1=CC=CC=C1C(CCC)(CCC)[NH3+].[Cl-]

InChI

InChI=1S/C16H27N.ClH/c1-4-9-14-10-7-8-11-15(14)16(17,12-5-2)13-6-3;/h7-8,10-11H,4-6,9,12-13,17H2,1-3H3;1H