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

Systemtic Name: [3-cyano-4-methyl-3-(naphthalen-1-ylmethyl)pentyl]-bis(3-methylbut-2-enyl)azanium chloride Openeye Name: [3-cyano-4-methyl-3-(1-naphthylmethyl)pentyl]-bis(3-methylbut-2-enyl)ammonium chloride CAS Name: [3-cyano-4-methyl-3-(1-naphthalenylmethyl)pentyl]-bis(3-methylbut-2-enyl)ammonium chloride IUPAC Name: [3-cyano-4-methyl-3-(naphthalen-1-ylmethyl)pentyl]-bis(3-methylbut-2-enyl)azanium chloride Traditional Name: [3-cyano-4-methyl-3-(1-naphthylmethyl)pentyl]-bis(3-methylbut-2-enyl)ammonium chloride Formula: C28H39ClN2 MolecularWeight: 439.07566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC[NH+](CC=C(C)C)CC=C(C)C)(CC1=CC=CC2=CC=CC=C21)C#N.[Cl-]

Isomeric SMILES

CC(C)C(CC[NH+](CC=C(C)C)CC=C(C)C)(CC1=CC=CC2=CC=CC=C21)C#N.[Cl-]

InChI

InChI=1S/C28H38N2.ClH/c1-22(2)14-17-30(18-15-23(3)4)19-16-28(21-29,24(5)6)20-26-12-9-11-25-10-7-8-13-27(25)26;/h7-15,24H,16-20H2,1-6H3;1H