2-(4-pentylcyclohexyl)ethyl-triphenyl-phosphanium bromide

Systemtic Name: 2-(4-pentylcyclohexyl)ethyl-triphenyl-phosphanium bromide Openeye Name: 2-(4-pentylcyclohexyl)ethyl-triphenyl-phosphonium bromide CAS Name: 2-(4-pentylcyclohexyl)ethyl-triphenylphosphonium bromide IUPAC Name: 2-(4-pentylcyclohexyl)ethyl-triphenylphosphanium bromide Traditional Name: 2-(4-amylcyclohexyl)ethyl-triphenyl-phosphonium bromide Formula: C31H40BrP MolecularWeight: 523.527061

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)CC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

CCCCCC1CCC(CC1)CC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C31H40P.BrH/c1-2-3-7-14-27-21-23-28(24-22-27)25-26-32(29-15-8-4-9-16-29,30-17-10-5-11-18-30)31-19-12-6-13-20-31;/h4-6,8-13,15-20,27-28H,2-3,7,14,21-26H2,1H3;1H/q+1;/p-1