(3-ethyl-4-phenyl-icosan-3-yl)azanium chloride

Systemtic Name: (3-ethyl-4-phenyl-icosan-3-yl)azanium chloride Openeye Name: (1,1-diethyl-2-phenyl-octadecyl)ammonium chloride CAS Name: (3-ethyl-4-phenyleicosan-3-yl)ammonium chloride IUPAC Name: (3-ethyl-4-phenylicosan-3-yl)azanium chloride Traditional Name: (1,1-diethyl-2-phenyl-octadecyl)ammonium chloride Formula: C28H52ClN MolecularWeight: 438.17218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H51N.ClH/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-22-25-27(28(29,5-2)6-3)26-23-20-19-21-24-26;/h19-21,23-24,27H,4-18,22,25,29H2,1-3H3;1H