iridium(3+); 2-[(phenylmethylidene)amino]benzoate

Systemtic Name: iridium(3+); 2-[(phenylmethylidene)amino]benzoate Openeye Name: 2-(benzylideneamino)benzoate; iridium(3+) CAS Name: iridium(3+); 2-[(phenylmethylene)amino]benzoate IUPAC Name: 2-(benzylideneamino)benzoate; iridium(3+) Traditional Name: 2-(benzalamino)benzoate; iridium(3+) Formula: C42H30IrN3O6 MolecularWeight: 864.9211

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=NC2=CC=CC=C2C(=O)[O-].C1=CC=C(C=C1)C=NC2=CC=CC=C2C(=O)[O-].C1=CC=C(C=C1)C=NC2=CC=CC=C2C(=O)[O-].[Ir+3]

Isomeric SMILES

C1=CC=C(C=C1)C=NC2=CC=CC=C2C(=O)[O-].C1=CC=C(C=C1)C=NC2=CC=CC=C2C(=O)[O-].C1=CC=C(C=C1)C=NC2=CC=CC=C2C(=O)[O-].[Ir+3]

InChI

InChI=1S/3C14H11NO2.Ir/c3*16-14(17)12-8-4-5-9-13(12)15-10-11-6-2-1-3-7-11;/h3*1-10H,(H,16,17);/q;;;+3/p-3