(4-chlorophenyl)methyl-(6-phenylazanylhexyl)-bis(prop-2-enyl)azanium chloride

Systemtic Name: (4-chlorophenyl)methyl-(6-phenylazanylhexyl)-bis(prop-2-enyl)azanium chloride Openeye Name: diallyl-(6-anilinohexyl)-[(4-chlorophenyl)methyl]ammonium chloride CAS Name: 6-anilinohexyl-[(4-chlorophenyl)methyl]-bis(prop-2-enyl)ammonium chloride IUPAC Name: 6-anilinohexyl-[(4-chlorophenyl)methyl]-bis(prop-2-enyl)azanium chloride Traditional Name: diallyl-(6-anilinohexyl)-(4-chlorobenzyl)ammonium chloride Formula: C25H34Cl2N2 MolecularWeight: 433.45686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+](CCCCCCNC1=CC=CC=C1)(CC=C)CC2=CC=C(C=C2)Cl.[Cl-]

Isomeric SMILES

C=CC[N+](CCCCCCNC1=CC=CC=C1)(CC=C)CC2=CC=C(C=C2)Cl.[Cl-]

InChI

InChI=1S/C25H34ClN2.ClH/c1-3-19-28(20-4-2,22-23-14-16-24(26)17-15-23)21-11-6-5-10-18-27-25-12-8-7-9-13-25;/h3-4,7-9,12-17,27H,1-2,5-6,10-11,18-22H2;1H/q+1;/p-1