1-[(2-methylphenyl)amino]ethyl-triphenyl-phosphanium bromide

Systemtic Name: 1-[(2-methylphenyl)amino]ethyl-triphenyl-phosphanium bromide Openeye Name: 1-(2-methylanilino)ethyl-triphenyl-phosphonium bromide CAS Name: 1-(2-methylanilino)ethyl-triphenylphosphonium bromide IUPAC Name: 1-(2-methylanilino)ethyl-triphenylphosphanium bromide Traditional Name: 1-(o-toluidino)ethyl-triphenyl-phosphonium bromide Formula: C27H27BrNP MolecularWeight: 476.387741

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(C)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

CC1=CC=CC=C1NC(C)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C27H27NP.BrH/c1-22-14-12-13-21-27(22)28-23(2)29(24-15-6-3-7-16-24,25-17-8-4-9-18-25)26-19-10-5-11-20-26;/h3-21,23,28H,1-2H3;1H/q+1;/p-1