(3-cyano-4-methyl-3-naphthalen-1-yl-pentyl)-bis(3-methylbut-2-enyl)azanium chloride

Systemtic Name: (3-cyano-4-methyl-3-naphthalen-1-yl-pentyl)-bis(3-methylbut-2-enyl)azanium chloride Openeye Name: [3-cyano-4-methyl-3-(1-naphthyl)pentyl]-bis(3-methylbut-2-enyl)ammonium chloride CAS Name: [3-cyano-4-methyl-3-(1-naphthalenyl)pentyl]-bis(3-methylbut-2-enyl)ammonium chloride IUPAC Name: (3-cyano-4-methyl-3-naphthalen-1-ylpentyl)-bis(3-methylbut-2-enyl)azanium chloride Traditional Name: [3-cyano-4-methyl-3-(1-naphthyl)pentyl]-bis(3-methylbut-2-enyl)ammonium chloride Formula: C27H37ClN2 MolecularWeight: 425.04908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC[NH+](CC=C(C)C)CC=C(C)C)(C#N)C1=CC=CC2=CC=CC=C21.[Cl-]

Isomeric SMILES

CC(C)C(CC[NH+](CC=C(C)C)CC=C(C)C)(C#N)C1=CC=CC2=CC=CC=C21.[Cl-]

InChI

InChI=1S/C27H36N2.ClH/c1-21(2)14-17-29(18-15-22(3)4)19-16-27(20-28,23(5)6)26-13-9-11-24-10-7-8-12-25(24)26;/h7-15,23H,16-19H2,1-6H3;1H