[(E)-1-phenylhenicos-1-en-6-yl]azanium chloride

Systemtic Name: [(E)-1-phenylhenicos-1-en-6-yl]azanium chloride Openeye Name: 1-[(E)-5-phenylpent-4-enyl]hexadecylammonium chloride CAS Name: [(E)-1-phenylheneicos-1-en-6-yl]ammonium chloride IUPAC Name: [(E)-1-phenylhenicos-1-en-6-yl]azanium chloride Traditional Name: [(E)-1-pentadecyl-6-phenyl-hex-5-enyl]ammonium chloride Formula: C27H48ClN MolecularWeight: 422.12972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H47N.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-19-24-27(28)25-20-15-18-23-26-21-16-14-17-22-26;/h14,16-18,21-23,27H,2-13,15,19-20,24-25,28H2,1H3;1H/b23-18+;