[2-(4-butyl-2-phenyl-imidazo[1,2-a]benzimidazol-1-yl)-2-oxidanylidene-ethyl]-triphenyl-phosphanium bromide

Systemtic Name: [2-(4-butyl-2-phenyl-imidazo[1,2-a]benzimidazol-1-yl)-2-oxidanylidene-ethyl]-triphenyl-phosphanium bromide Openeye Name: [2-(4-butyl-2-phenyl-imidazo[1,2-a]benzimidazol-1-yl)-2-oxo-ethyl]-triphenyl-phosphonium bromide CAS Name: [2-(4-butyl-2-phenyl-1-imidazo[1,2-a]benzimidazolyl)-2-oxoethyl]-triphenylphosphonium bromide IUPAC Name: [2-(4-butyl-2-phenylimidazo[1,2-a]benzimidazol-1-yl)-2-oxoethyl]-triphenylphosphanium bromide Traditional Name: [2-(4-butyl-2-phenyl-imidazo[1,2-a]benzimidazol-1-yl)-2-keto-ethyl]-triphenyl-phosphonium bromide Formula: C39H35BrN3OP MolecularWeight: 672.592461

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2N3C1=NC(=C3C(=O)C[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7.[Br-]

Isomeric SMILES

CCCCN1C2=CC=CC=C2N3C1=NC(=C3C(=O)C[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7.[Br-]

InChI

InChI=1S/C39H35N3OP.BrH/c1-2-3-28-41-34-26-16-17-27-35(34)42-38(37(40-39(41)42)30-18-8-4-9-19-30)36(43)29-44(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