1-(4-bromophenyl)-2-[4,6-diphenyl-1-(phenylmethyl)pyridin-1-ium-2-yl]-3-phenyl-propane-1,3-dione

Systemtic Name: 1-(4-bromophenyl)-2-[4,6-diphenyl-1-(phenylmethyl)pyridin-1-ium-2-yl]-3-phenyl-propane-1,3-dione Openeye Name: 2-(1-benzyl-4,6-diphenyl-pyridin-1-ium-2-yl)-1-(4-bromophenyl)-3-phenyl-propane-1,3-dione CAS Name: 1-(4-bromophenyl)-2-[4,6-diphenyl-1-(phenylmethyl)-2-pyridin-1-iumyl]-3-phenylpropane-1,3-dione IUPAC Name: 2-(1-benzyl-4,6-diphenylpyridin-1-ium-2-yl)-1-(4-bromophenyl)-3-phenylpropane-1,3-dione Traditional Name: 2-(1-benzyl-4,6-diphenyl-pyridin-1-ium-2-yl)-1-(4-bromophenyl)-3-phenyl-propane-1,3-dione Formula: C39H29BrNO2+ MolecularWeight: 623.55706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=C(C=C(C=C2C(C(=O)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Br)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=C(C=C(C=C2C(C(=O)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Br)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C39H29BrNO2/c40-34-23-21-32(22-24-34)39(43)37(38(42)31-19-11-4-12-20-31)36-26-33(29-15-7-2-8-16-29)25-35(30-17-9-3-10-18-30)41(36)27-28-13-5-1-6-14-28/h1-26,37H,27H2/q+1