[1-(oxolan-2-ylmethyl)pyrrolidin-3-yl]-triphenyl-phosphanium bromide

Systemtic Name: [1-(oxolan-2-ylmethyl)pyrrolidin-3-yl]-triphenyl-phosphanium bromide Openeye Name: triphenyl-[1-(tetrahydrofuran-2-ylmethyl)pyrrolidin-3-yl]phosphonium bromide CAS Name: [1-(2-oxolanylmethyl)-3-pyrrolidinyl]-triphenylphosphonium bromide IUPAC Name: [1-(oxolan-2-ylmethyl)pyrrolidin-3-yl]-triphenylphosphanium bromide Traditional Name: triphenyl-[1-(tetrahydrofurfuryl)pyrrolidin-3-yl]phosphonium bromide Formula: C27H31BrNOP MolecularWeight: 496.418901

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2CCC(C2)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

C1CC(OC1)CN2CCC(C2)[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C27H31NOP.BrH/c1-4-12-24(13-5-1)30(25-14-6-2-7-15-25,26-16-8-3-9-17-26)27-18-19-28(22-27)21-23-11-10-20-29-23;/h1-9,12-17,23,27H,10-11,18-22H2;1H/q+1;/p-1