4-(benzotriazol-2-yl)-N,N-dimethyl-naphthalen-1-amine; iridium; pentane-2,4-dione

Systemtic Name: 4-(benzotriazol-2-yl)-N,N-dimethyl-naphthalen-1-amine; iridium; pentane-2,4-dione Openeye Name: 4-(benzotriazol-2-yl)-N,N-dimethyl-naphthalen-1-amine; iridium; pentane-2,4-dione CAS Name: 4-(2-benzotriazolyl)-N,N-dimethyl-1-naphthalenamine; iridium; pentane-2,4-dione IUPAC Name: 4-(benzotriazol-2-yl)-N,N-dimethylnaphthalen-1-amine; iridium; pentane-2,4-dione Traditional Name: [4-(benzotriazol-2-yl)-1-naphthyl]-dimethyl-amine; iridium; pentane-2,4-dione Formula: C41H40IrN8O2 MolecularWeight: 869.0257

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)C.CN(C)C1=CC=C(C2=CC=CC=C21)N3N=C4C=CC=CC4=N3.CN(C)C1=CC=C(C2=CC=CC=C21)N3N=C4C=CC=CC4=N3.[Ir]

Isomeric SMILES

CC(=O)CC(=O)C.CN(C)C1=CC=C(C2=CC=CC=C21)N3N=C4C=CC=CC4=N3.CN(C)C1=CC=C(C2=CC=CC=C21)N3N=C4C=CC=CC4=N3.[Ir]

InChI

InChI=1S/2C18H16N4.C5H8O2.Ir/c2*1-21(2)17-11-12-18(14-8-4-3-7-13(14)17)22-19-15-9-5-6-10-16(15)20-22;1-4(6)3-5(2)7;/h2*3-12H,1-2H3;3H2,1-2H3;