(5-naphthalen-1-yl-4-propyl-heptadecan-4-yl)azanium chloride

Systemtic Name: (5-naphthalen-1-yl-4-propyl-heptadecan-4-yl)azanium chloride Openeye Name: [2-(1-naphthyl)-1,1-dipropyl-tetradecyl]ammonium chloride CAS Name: [5-(1-naphthalenyl)-4-propylheptadecan-4-yl]ammonium chloride IUPAC Name: (5-naphthalen-1-yl-4-propylheptadecan-4-yl)azanium chloride Traditional Name: [2-(1-naphthyl)-1,1-dipropyl-tetradecyl]ammonium chloride Formula: C30H50ClN MolecularWeight: 460.1777

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C1=CC=CC2=CC=CC=C21)C(CCC)(CCC)[NH3+].[Cl-]

Isomeric SMILES

CCCCCCCCCCCCC(C1=CC=CC2=CC=CC=C21)C(CCC)(CCC)[NH3+].[Cl-]

InChI

InChI=1S/C30H49N.ClH/c1-4-7-8-9-10-11-12-13-14-15-23-29(30(31,24-5-2)25-6-3)28-22-18-20-26-19-16-17-21-27(26)28;/h16-22,29H,4-15,23-25,31H2,1-3H3;1H