4-bromanyl-2,6-dimethyl-phenolate; tetraphenylphosphanium

Systemtic Name: 4-bromanyl-2,6-dimethyl-phenolate; tetraphenylphosphanium Openeye Name: 4-bromo-2,6-dimethyl-phenolate; tetraphenylphosphonium CAS Name: 4-bromo-2,6-dimethylphenolate; tetraphenylphosphonium IUPAC Name: 4-bromo-2,6-dimethylphenolate; tetraphenylphosphanium Traditional Name: 4-bromo-2,6-dimethyl-phenolate; tetraphenylphosphonium Formula: C32H28BrOP MolecularWeight: 539.441881

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1[O-])C)Br.C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC(=C1[O-])C)Br.C1=CC=C(C=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H20P.C8H9BrO/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-5-3-7(9)4-6(2)8(5)10/h1-20H;3-4,10H,1-2H3/q+1;/p-1