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

Systemtic Name: [2-[3-butyl-2,4-bis(oxidanylidene)-1-phenyl-quinolin-3-yl]oxy-2-oxidanylidene-ethyl]-triphenyl-phosphanium bromide Openeye Name: [2-[(3-butyl-2,4-dioxo-1-phenyl-3-quinolyl)oxy]-2-oxo-ethyl]-triphenyl-phosphonium bromide CAS Name: [2-[(3-butyl-2,4-dioxo-1-phenyl-3-quinolinyl)oxy]-2-oxoethyl]-triphenylphosphonium bromide IUPAC Name: [2-(3-butyl-2,4-dioxo-1-phenylquinolin-3-yl)oxy-2-oxoethyl]-triphenylphosphanium bromide Traditional Name: [2-[(3-butyl-2,4-diketo-1-phenyl-3-quinolyl)oxy]-2-keto-ethyl]-triphenyl-phosphonium bromide Formula: C39H35BrNO4P MolecularWeight: 692.577261

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(=O)C2=CC=CC=C2N(C1=O)C3=CC=CC=C3)OC(=O)C[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Br-]

Isomeric SMILES

CCCCC1(C(=O)C2=CC=CC=C2N(C1=O)C3=CC=CC=C3)OC(=O)C[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Br-]

InChI

InChI=1S/C39H35NO4P.BrH/c1-2-3-28-39(37(42)34-26-16-17-27-35(34)40(38(39)43)30-18-8-4-9-19-30)44-36(41)29-45(31-20-10-5-11-21-31,32-22-12-6-13-23-32)33-24-14-7-15-25-33;/h4-27H,2-3,28-29H2,1H3;1H/q+1;/p-1