(2,3-diphenylphenyl)-diphenyl-(quinoxalin-6-ylmethyl)phosphanium bromide

Systemtic Name: (2,3-diphenylphenyl)-diphenyl-(quinoxalin-6-ylmethyl)phosphanium bromide Openeye Name: (2,3-diphenylphenyl)-diphenyl-(quinoxalin-6-ylmethyl)phosphonium bromide CAS Name: (2,3-diphenylphenyl)-diphenyl-(6-quinoxalinylmethyl)phosphonium bromide IUPAC Name: (2,3-diphenylphenyl)-diphenyl-(quinoxalin-6-ylmethyl)phosphanium bromide Traditional Name: (2,3-diphenylphenyl)-diphenyl-(quinoxalin-6-ylmethyl)phosphonium bromide Formula: C39H30BrN2P MolecularWeight: 637.546661

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=CC=C2)[P+](CC3=CC4=NC=CN=C4C=C3)(C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=CC=C2)[P+](CC3=CC4=NC=CN=C4C=C3)(C5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7.[Br-]

InChI

InChI=1S/C39H30N2P.BrH/c1-5-14-31(15-6-1)35-22-13-23-38(39(35)32-16-7-2-8-17-32)42(33-18-9-3-10-19-33,34-20-11-4-12-21-34)29-30-24-25-36-37(28-30)41-27-26-40-36;/h1-28H,29H2;1H/q+1;/p-1