[4-methoxy-2,4-bis(oxidanylidene)butyl]-triphenyl-phosphanium bromide

Systemtic Name: [4-methoxy-2,4-bis(oxidanylidene)butyl]-triphenyl-phosphanium bromide Openeye Name: (4-methoxy-2,4-dioxo-butyl)-triphenyl-phosphonium bromide CAS Name: (4-methoxy-2,4-dioxobutyl)-triphenylphosphonium bromide IUPAC Name: (4-methoxy-2,4-dioxobutyl)-triphenylphosphanium bromide Traditional Name: (2,4-diketo-4-methoxy-butyl)-triphenyl-phosphonium bromide Formula: C23H22BrO3P MolecularWeight: 457.296741

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H22O3P.BrH/c1-26-23(25)17-19(24)18-27(20-11-5-2-6-12-20,21-13-7-3-8-14-21)22-15-9-4-10-16-22;/h2-16H,17-18H2,1H3;1H/q+1;/p-1