4-bromanyl-2,6-dimethyl-phenolate; methyl(triphenyl)phosphanium

Systemtic Name: 4-bromanyl-2,6-dimethyl-phenolate; methyl(triphenyl)phosphanium Openeye Name: 4-bromo-2,6-dimethyl-phenolate; methyl(triphenyl)phosphonium CAS Name: 4-bromo-2,6-dimethylphenolate; methyl(triphenyl)phosphonium IUPAC Name: 4-bromo-2,6-dimethylphenolate; methyl(triphenyl)phosphanium Traditional Name: 4-bromo-2,6-dimethyl-phenolate; methyl(triphenyl)phosphonium Formula: C27H26BrOP MolecularWeight: 477.372501

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18P.C8H9BrO/c1-20(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-19;1-5-3-7(9)4-6(2)8(5)10/h2-16H,1H3;3-4,10H,1-2H3/q+1;/p-1