[4-[4-(4-pentylcyclohexyl)phenyl]phenyl]methyl-triphenyl-phosphanium bromide

Systemtic Name: [4-[4-(4-pentylcyclohexyl)phenyl]phenyl]methyl-triphenyl-phosphanium bromide Openeye Name: [4-[4-(4-pentylcyclohexyl)phenyl]phenyl]methyl-triphenyl-phosphonium bromide CAS Name: [4-[4-(4-pentylcyclohexyl)phenyl]phenyl]methyl-triphenylphosphonium bromide IUPAC Name: [4-[4-(4-pentylcyclohexyl)phenyl]phenyl]methyl-triphenylphosphanium bromide Traditional Name: [4-[4-(4-amylcyclohexyl)phenyl]benzyl]-triphenyl-phosphonium bromide Formula: C42H46BrP MolecularWeight: 661.692401

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Br-]

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Br-]

InChI

InChI=1S/C42H46P.BrH/c1-2-3-7-14-34-21-25-36(26-22-34)38-29-31-39(32-30-38)37-27-23-35(24-28-37)33-43(40-15-8-4-9-16-40,41-17-10-5-11-18-41)42-19-12-6-13-20-42;/h4-6,8-13,15-20,23-24,27-32,34,36H,2-3,7,14,21-22,25-26,33H2,1H3;1H/q+1;/p-1