2-(benzimidazol-1-id-2-yl)quinoline; iridium; (Z)-4-oxidanylpent-3-en-2-one

Systemtic Name: 2-(benzimidazol-1-id-2-yl)quinoline; iridium; (Z)-4-oxidanylpent-3-en-2-one Openeye Name: 2-(benzimidazol-1-id-2-yl)quinoline; (Z)-4-hydroxypent-3-en-2-one; iridium CAS Name: 2-(2-benzimidazol-1-idyl)quinoline; (Z)-4-hydroxy-3-penten-2-one; iridium IUPAC Name: 2-(benzimidazol-1-id-2-yl)quinoline; (Z)-4-hydroxypent-3-en-2-one; iridium Traditional Name: 2-(benzimidazol-1-id-2-yl)quinoline; (Z)-4-hydroxypent-3-en-2-one; iridium Formula: C21H18IrN3O2- MolecularWeight: 536.60352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C)O.C1=CC=C2C(=C1)C=CC(=N2)C3=NC4=CC=CC=C4[N-]3.[Ir]

Isomeric SMILES

C/C(=C/C(=O)C)/O.C1=CC=C2C(=C1)C=CC(=N2)C3=NC4=CC=CC=C4[N-]3.[Ir]

InChI

InChI=1S/C16H10N3.C5H8O2.Ir/c1-2-6-12-11(5-1)9-10-15(17-12)16-18-13-7-3-4-8-14(13)19-16;1-4(6)3-5(2)7;/h1-10H;3,6H,1-2H3;/q-1;;/b;4-3-;