[5,9-diethyl-7-(phenylmethyl)tridecan-7-yl]azanium chloride

Systemtic Name: [5,9-diethyl-7-(phenylmethyl)tridecan-7-yl]azanium chloride Openeye Name: [1-benzyl-3-ethyl-1-(2-ethylhexyl)heptyl]ammonium chloride CAS Name: [5,9-diethyl-7-(phenylmethyl)tridecan-7-yl]ammonium chloride IUPAC Name: (7-benzyl-5,9-diethyltridecan-7-yl)azanium chloride Traditional Name: [1-benzyl-3-ethyl-1-(2-ethylhexyl)heptyl]ammonium chloride Formula: C24H44ClN MolecularWeight: 382.06586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(CC1=CC=CC=C1)(CC(CC)CCCC)[NH3+].[Cl-]

Isomeric SMILES

CCCCC(CC)CC(CC1=CC=CC=C1)(CC(CC)CCCC)[NH3+].[Cl-]

InChI

InChI=1S/C24H43N.ClH/c1-5-9-14-21(7-3)18-24(25,19-22(8-4)15-10-6-2)20-23-16-12-11-13-17-23;/h11-13,16-17,21-22H,5-10,14-15,18-20,25H2,1-4H3;1H