2,4-diphenylhexadecan-5-ylazanium chloride

Systemtic Name: 2,4-diphenylhexadecan-5-ylazanium chloride Openeye Name: 1-(1,3-diphenylbutyl)dodecylammonium chloride CAS Name: 2,4-diphenylhexadecan-5-ylammonium chloride IUPAC Name: 2,4-diphenylhexadecan-5-ylazanium chloride Traditional Name: 1-(1,3-diphenylbutyl)dodecylammonium chloride Formula: C28H44ClN MolecularWeight: 430.10866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(C(CC(C)C1=CC=CC=C1)C2=CC=CC=C2)[NH3+].[Cl-]

Isomeric SMILES

CCCCCCCCCCCC(C(CC(C)C1=CC=CC=C1)C2=CC=CC=C2)[NH3+].[Cl-]

InChI

InChI=1S/C28H43N.ClH/c1-3-4-5-6-7-8-9-10-17-22-28(29)27(26-20-15-12-16-21-26)23-24(2)25-18-13-11-14-19-25;/h11-16,18-21,24,27-28H,3-10,17,22-23,29H2,1-2H3;1H