2-(1-cyanopropan-2-ylamino)ethyl-triphenyl-phosphanium bromide

Systemtic Name: 2-(1-cyanopropan-2-ylamino)ethyl-triphenyl-phosphanium bromide Openeye Name: 2-[(2-cyano-1-methyl-ethyl)amino]ethyl-triphenyl-phosphonium bromide CAS Name: 2-(1-cyanopropan-2-ylamino)ethyl-triphenylphosphonium bromide IUPAC Name: 2-(1-cyanopropan-2-ylamino)ethyl-triphenylphosphanium bromide Traditional Name: 2-[(2-cyano-1-methyl-ethyl)amino]ethyl-triphenyl-phosphonium bromide Formula: C24H26BrN2P MolecularWeight: 453.354401

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC#N)NCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

Isomeric SMILES

CC(CC#N)NCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C24H26N2P.BrH/c1-21(17-18-25)26-19-20-27(22-11-5-2-6-12-22,23-13-7-3-8-14-23)24-15-9-4-10-16-24;/h2-16,21,26H,17,19-20H2,1H3;1H/q+1;/p-1