triphenyl-(3-pyridin-2-yl-2,10b-dihydro-1H-pyrazolo[5,1-a]isoquinolin-1-yl)phosphanium bromide

Systemtic Name: triphenyl-(3-pyridin-2-yl-2,10b-dihydro-1H-pyrazolo[5,1-a]isoquinolin-1-yl)phosphanium bromide Openeye Name: triphenyl-[3-(2-pyridyl)-2,10b-dihydro-1H-pyrazolo[5,1-a]isoquinolin-1-yl]phosphonium bromide CAS Name: triphenyl-[3-(2-pyridinyl)-2,10b-dihydro-1H-pyrazolo[5,1-a]isoquinolin-1-yl]phosphonium bromide IUPAC Name: triphenyl-(3-pyridin-2-yl-2,10b-dihydro-1H-pyrazolo[5,1-a]isoquinolin-1-yl)phosphanium bromide Traditional Name: triphenyl-[3-(2-pyridyl)-2,10b-dihydro-1H-pyrazol[5,1-a]isoquinolin-1-yl]phosphonium bromide Formula: C34H29BrN3P MolecularWeight: 590.491921

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2C3=CC=CC=C3C=CN2N1C4=CC=CC=N4)[P+](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7.[Br-]

Isomeric SMILES

C1C(C2C3=CC=CC=C3C=CN2N1C4=CC=CC=N4)[P+](C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7.[Br-]

InChI

InChI=1S/C34H29N3P.BrH/c1-4-15-28(16-5-1)38(29-17-6-2-7-18-29,30-19-8-3-9-20-30)32-26-37(33-22-12-13-24-35-33)36-25-23-27-14-10-11-21-31(27)34(32)36;/h1-25,32,34H,26H2;1H/q+1;/p-1