iridium; (Z)-4-oxidanylpent-3-en-2-one; 1-[3-(trifluoromethyl)benzene-6-id-1-yl]indazole

Systemtic Name: iridium; (Z)-4-oxidanylpent-3-en-2-one; 1-[3-(trifluoromethyl)benzene-6-id-1-yl]indazole Openeye Name: (Z)-4-hydroxypent-3-en-2-one; iridium; 1-[3-(trifluoromethyl)benzene-6-id-1-yl]indazole CAS Name: (Z)-4-hydroxy-3-penten-2-one; iridium; 1-[3-(trifluoromethyl)-1-benzene-6-idyl]indazole IUPAC Name: (Z)-4-hydroxypent-3-en-2-one; iridium; 1-[3-(trifluoromethyl)benzene-6-id-1-yl]indazole Traditional Name: (Z)-4-hydroxypent-3-en-2-one; iridium; 1-[3-(trifluoromethyl)benzene-6-id-1-yl]indazole Formula: C19H16F3IrN2O2- MolecularWeight: 553.55475

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C)O.C1=CC=C2C(=C1)C=NN2C3=CC(=CC=[C-]3)C(F)(F)F.[Ir]

Isomeric SMILES

C/C(=C/C(=O)C)/O.C1=CC=C2C(=C1)C=NN2C3=CC(=CC=[C-]3)C(F)(F)F.[Ir]

InChI

InChI=1S/C14H8F3N2.C5H8O2.Ir/c15-14(16,17)11-5-3-6-12(8-11)19-13-7-2-1-4-10(13)9-18-19;1-4(6)3-5(2)7;/h1-5,7-9H;3,6H,1-2H3;/q-1;;/b;4-3-;