2-[3-(4-chlorophenyl)propyl]-3-heptyl-1H-imidazol-3-ium chloride

Systemtic Name: 2-[3-(4-chlorophenyl)propyl]-3-heptyl-1H-imidazol-3-ium chloride Openeye Name: 2-[3-(4-chlorophenyl)propyl]-3-heptyl-1H-imidazol-3-ium chloride CAS Name: 2-[3-(4-chlorophenyl)propyl]-3-heptyl-1H-imidazol-3-ium chloride IUPAC Name: 2-[3-(4-chlorophenyl)propyl]-3-heptyl-1H-imidazol-3-ium chloride Traditional Name: 2-[3-(4-chlorophenyl)propyl]-3-heptyl-1H-imidazol-3-ium chloride Formula: C19H28Cl2N2 MolecularWeight: 355.34502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[N+]1=C(NC=C1)CCCC2=CC=C(C=C2)Cl.[Cl-]

Isomeric SMILES

CCCCCCC[N+]1=C(NC=C1)CCCC2=CC=C(C=C2)Cl.[Cl-]

InChI

InChI=1S/C19H27ClN2.ClH/c1-2-3-4-5-6-15-22-16-14-21-19(22)9-7-8-17-10-12-18(20)13-11-17;/h10-14,16H,2-9,15H2,1H3;1H