diphenyl-[2-[3-(2,4,6-trimethylphenyl)imidazol-1-ium-1-yl]ethyl]phosphane bromide

Systemtic Name: diphenyl-[2-[3-(2,4,6-trimethylphenyl)imidazol-1-ium-1-yl]ethyl]phosphane bromide Openeye Name: diphenyl-[2-[3-(2,4,6-trimethylphenyl)imidazol-1-ium-1-yl]ethyl]phosphane bromide CAS Name: diphenyl-[2-[3-(2,4,6-trimethylphenyl)-1-imidazol-1-iumyl]ethyl]phosphine bromide IUPAC Name: diphenyl-[2-[3-(2,4,6-trimethylphenyl)imidazol-1-ium-1-yl]ethyl]phosphane bromide Traditional Name: 2-(3-mesitylimidazol-1-ium-1-yl)ethyl-diphenyl-phosphine bromide Formula: C26H28BrN2P MolecularWeight: 479.391681

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)N2C=C[N+](=C2)CCP(C3=CC=CC=C3)C4=CC=CC=C4)C.[Br-]

Isomeric SMILES

CC1=CC(=C(C(=C1)C)N2C=C[N+](=C2)CCP(C3=CC=CC=C3)C4=CC=CC=C4)C.[Br-]

InChI

InChI=1S/C26H28N2P.BrH/c1-21-18-22(2)26(23(3)19-21)28-15-14-27(20-28)16-17-29(24-10-6-4-7-11-24)25-12-8-5-9-13-25;/h4-15,18-20H,16-17H2,1-3H3;1H/q+1;/p-1