2-methyl-4,4-diphenyl-1,4-benzoxaphosphinin-4-ium bromide

Systemtic Name: 2-methyl-4,4-diphenyl-1,4-benzoxaphosphinin-4-ium bromide Openeye Name: 2-methyl-4,4-diphenyl-1,4-benzoxaphosphinin-4-ium bromide CAS Name: 2-methyl-4,4-diphenyl-1,4-benzoxaphosphorin-4-ium bromide IUPAC Name: 2-methyl-4,4-diphenyl-1,4-benzoxaphosphinin-4-ium bromide Traditional Name: 2-methyl-4,4-diphenyl-1,4-benzoxaphosphorin-4-ium bromide Formula: C21H18BrOP MolecularWeight: 397.244781

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[P+](C2=CC=CC=C2O1)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

CC1=C[P+](C2=CC=CC=C2O1)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C21H18OP.BrH/c1-17-16-23(18-10-4-2-5-11-18,19-12-6-3-7-13-19)21-15-9-8-14-20(21)22-17;/h2-16H,1H3;1H/q+1;/p-1