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3-(3,4-dimethoxyphenyl)propyl-triphenyl-phosphanium bromide

3-(3,4-dimethoxyphenyl)propyl-triphenyl-phosphanium bromide

Systemtic Name:3-(3,4-dimethoxyphenyl)propyl-triphenyl-phosphanium bromide
Openeye Name:3-(3,4-dimethoxyphenyl)propyl-triphenyl-phosphonium bromide
CAS Name:3-(3,4-dimethoxyphenyl)propyl-triphenylphosphonium bromide
IUPAC Name:3-(3,4-dimethoxyphenyl)propyl-triphenylphosphanium bromide
Traditional Name:3-(3,4-dimethoxyphenyl)propyl-triphenyl-phosphonium bromide
Formula: C29H30BrO2P
MolecularWeight: 521.425061
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)OC.[Br-]


Isomeric SMILES

COC1=C(C=C(C=C1)CCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)OC.[Br-]


InChI

InChI=1S/C29H30O2P.BrH/c1-30-28-21-20-24(23-29(28)31-2)13-12-22-32(25-14-6-3-7-15-25,26-16-8-4-9-17-26)27-18-10-5-11-19-27;/h3-11,14-21,23H,12-13,22H2,1-2H3;1H/q+1;/p-1


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