iridium; (Z)-4-oxidanyl-4-phenyl-but-3-en-2-one; 2-(3H-thiophen-3-id-2-yl)-2H-quinolin-1-ide

Systemtic Name: iridium; (Z)-4-oxidanyl-4-phenyl-but-3-en-2-one; 2-(3H-thiophen-3-id-2-yl)-2H-quinolin-1-ide Openeye Name: (Z)-4-hydroxy-4-phenyl-but-3-en-2-one; iridium; 2-(3H-thiophen-3-id-2-yl)-2H-quinolin-1-ide CAS Name: (Z)-4-hydroxy-4-phenyl-3-buten-2-one; iridium; 2-(3H-thiophen-3-id-2-yl)-2H-quinolin-1-ide IUPAC Name: (Z)-4-hydroxy-4-phenylbut-3-en-2-one; iridium; 2-(3H-thiophen-3-id-2-yl)-2H-quinolin-1-ide Traditional Name: (Z)-4-hydroxy-4-phenyl-but-3-en-2-one; iridium; 2-(3H-thiophen-3-id-2-yl)-2H-quinolin-1-ide Formula: C23H19IrNO2S-2 MolecularWeight: 565.68446

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=C(C1=CC=CC=C1)O.C1=CC=C2C(=C1)C=CC([N-]2)C3=[C-]C=CS3.[Ir]

Isomeric SMILES

CC(=O)/C=C(/C1=CC=CC=C1)\O.C1=CC=C2C(=C1)C=CC([N-]2)C3=[C-]C=CS3.[Ir]

InChI

InChI=1S/C13H9NS.C10H10O2.Ir/c1-2-5-11-10(4-1)7-8-12(14-11)13-6-3-9-15-13;1-8(11)7-10(12)9-5-3-2-4-6-9;/h1-5,7-9,12H;2-7,12H,1H3;/q-2;;/b;10-7-;