[2-[[3-butyl-2,4-bis(oxidanylidene)-1H-quinolin-3-yl]oxy]-2-oxidanylidene-ethyl]-triphenyl-phosphanium bromide

Systemtic Name: [2-[[3-butyl-2,4-bis(oxidanylidene)-1H-quinolin-3-yl]oxy]-2-oxidanylidene-ethyl]-triphenyl-phosphanium bromide Openeye Name: [2-[(3-butyl-2,4-dioxo-1H-quinolin-3-yl)oxy]-2-oxo-ethyl]-triphenyl-phosphonium bromide CAS Name: [2-[(3-butyl-2,4-dioxo-1H-quinolin-3-yl)oxy]-2-oxoethyl]-triphenylphosphonium bromide IUPAC Name: [2-[(3-butyl-2,4-dioxo-1H-quinolin-3-yl)oxy]-2-oxoethyl]-triphenylphosphanium bromide Traditional Name: [2-[(3-butyl-2,4-diketo-1H-quinolin-3-yl)oxy]-2-keto-ethyl]-triphenyl-phosphonium bromide Formula: C33H31BrNO4P MolecularWeight: 616.481301

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=O)C2=CC=CC=C2NC1=O)OC(=O)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

Isomeric SMILES

CCCCC1(C(=O)C2=CC=CC=C2NC1=O)OC(=O)C[P+](C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]

InChI

InChI=1S/C33H30NO4P.BrH/c1-2-3-23-33(31(36)28-21-13-14-22-29(28)34-32(33)37)38-30(35)24-39(25-15-7-4-8-16-25,26-17-9-5-10-18-26)27-19-11-6-12-20-27;/h4-22H,2-3,23-24H2,1H3;1H