(7,7-dimethyl-4-octyl-4,5,6,8-tetrahydrocarbazol-1-yl)methyl-triphenyl-phosphanium bromide

Systemtic Name: (7,7-dimethyl-4-octyl-4,5,6,8-tetrahydrocarbazol-1-yl)methyl-triphenyl-phosphanium bromide Openeye Name: (7,7-dimethyl-4-octyl-4,5,6,8-tetrahydrocarbazol-1-yl)methyl-triphenyl-phosphonium bromide CAS Name: (7,7-dimethyl-4-octyl-4,5,6,8-tetrahydrocarbazol-1-yl)methyl-triphenylphosphonium bromide IUPAC Name: (7,7-dimethyl-4-octyl-4,5,6,8-tetrahydrocarbazol-1-yl)methyl-triphenylphosphanium bromide Traditional Name: (7,7-dimethyl-4-octyl-4,5,6,8-tetrahydrocarbazol-1-yl)methyl-triphenyl-phosphonium bromide Formula: C41H49BrNP MolecularWeight: 666.712221

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1C=CC(=C2C1=C3CCC(CC3=N2)(C)C)C[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Br-]

Isomeric SMILES

CCCCCCCCC1C=CC(=C2C1=C3CCC(CC3=N2)(C)C)C[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Br-]

InChI

InChI=1S/C41H49NP.BrH/c1-4-5-6-7-8-12-19-32-26-27-33(40-39(32)37-28-29-41(2,3)30-38(37)42-40)31-43(34-20-13-9-14-21-34,35-22-15-10-16-23-35)36-24-17-11-18-25-36;/h9-11,13-18,20-27,32H,4-8,12,19,28-31H2,1-3H3;1H/q+1;/p-1