3,3-dimethyl-2-phenyl-indole; iridium; (2Z)-4-methylpenta-2,4-dien-2-ol

Systemtic Name: 3,3-dimethyl-2-phenyl-indole; iridium; (2Z)-4-methylpenta-2,4-dien-2-ol Openeye Name: 3,3-dimethyl-2-phenyl-indole; iridium; (2Z)-4-methylpenta-2,4-dien-2-ol CAS Name: 3,3-dimethyl-2-phenylindole; iridium; (2Z)-4-methyl-2-penta-2,4-dienol IUPAC Name: 3,3-dimethyl-2-phenylindole; iridium; (2Z)-4-methylpenta-2,4-dien-2-ol Traditional Name: 3,3-dimethyl-2-phenyl-indole; iridium; (2Z)-4-methylpenta-2,4-dien-2-ol Formula: C22H23IrNO-2 MolecularWeight: 509.64112

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Descriptors Computed from Structure

Canonical SMILES:

CC(=[CH-])C=C(C)O.CC1(C2=CC=CC=C2N=C1C3=CC=CC=[C-]3)C.[Ir]

Isomeric SMILES

CC(=[CH-])/C=C(/C)\O.CC1(C2=CC=CC=C2N=C1C3=CC=CC=[C-]3)C.[Ir]

InChI

InChI=1S/C16H14N.C6H9O.Ir/c1-16(2)13-10-6-7-11-14(13)17-15(16)12-8-4-3-5-9-12;1-5(2)4-6(3)7;/h3-8,10-11H,1-2H3;1,4,7H,2-3H3;/q2*-1;/b;6-4-;