heptan-2-yl(triphenyl)phosphanium bromide

Systemtic Name: heptan-2-yl(triphenyl)phosphanium bromide Openeye Name: 1-methylhexyl(triphenyl)phosphonium bromide CAS Name: heptan-2-yl(triphenyl)phosphonium bromide IUPAC Name: heptan-2-yl(triphenyl)phosphanium bromide Traditional Name: 1-methylhexyl(triphenyl)phosphonium bromide Formula: C25H30BrP MolecularWeight: 441.383461

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

Isomeric SMILES

CCCCCC(C)[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C25H30P.BrH/c1-3-4-8-15-22(2)26(23-16-9-5-10-17-23,24-18-11-6-12-19-24)25-20-13-7-14-21-25;/h5-7,9-14,16-22H,3-4,8,15H2,1-2H3;1H/q+1;/p-1