[(E)-octadec-12-enyl]-triphenyl-phosphanium bromide

Systemtic Name: [(E)-octadec-12-enyl]-triphenyl-phosphanium bromide Openeye Name: [(E)-octadec-12-enyl]-triphenyl-phosphonium bromide CAS Name: [(E)-octadec-12-enyl]-triphenylphosphonium bromide IUPAC Name: [(E)-octadec-12-enyl]-triphenylphosphanium bromide Traditional Name: [(E)-octadec-12-enyl]-triphenyl-phosphonium bromide Formula: C36H50BrP MolecularWeight: 593.659961

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCC/C=C/CCCCCCCCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C36H50P.BrH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-26-33-37(34-27-20-17-21-28-34,35-29-22-18-23-30-35)36-31-24-19-25-32-36;/h6-7,17-25,27-32H,2-5,8-16,26,33H2,1H3;1H/q+1;/p-1/b7-6+;