1,3-bis[(3-chlorophenyl)methyl]imidazol-1-ium bromide

Systemtic Name: 1,3-bis[(3-chlorophenyl)methyl]imidazol-1-ium bromide Openeye Name: 1,3-bis[(3-chlorophenyl)methyl]imidazol-1-ium bromide CAS Name: 1,3-bis[(3-chlorophenyl)methyl]imidazol-1-ium bromide IUPAC Name: 1,3-bis[(3-chlorophenyl)methyl]imidazol-1-ium bromide Traditional Name: 1,3-bis(3-chlorobenzyl)imidazol-1-ium bromide Formula: C17H15BrCl2N2 MolecularWeight: 398.1244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CN2C=C[N+](=C2)CC3=CC(=CC=C3)Cl.[Br-]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CN2C=C[N+](=C2)CC3=CC(=CC=C3)Cl.[Br-]

InChI

InChI=1S/C17H15Cl2N2.BrH/c18-16-5-1-3-14(9-16)11-20-7-8-21(13-20)12-15-4-2-6-17(19)10-15;/h1-10,13H,11-12H2;1H/q+1;/p-1