iridium; methyl 2-azanyl-3-(1-methylimidazol-4-yl)propanoate; 2-phenylquinoline; chloride

Systemtic Name: iridium; methyl 2-azanyl-3-(1-methylimidazol-4-yl)propanoate; 2-phenylquinoline; chloride Openeye Name: iridium; methyl 2-amino-3-(1-methylimidazol-4-yl)propanoate; 2-phenylquinoline; chloride CAS Name: 2-amino-3-(1-methyl-4-imidazolyl)propanoic acid methyl ester; iridium; 2-phenylquinoline; chloride IUPAC Name: iridium; methyl 2-amino-3-(1-methylimidazol-4-yl)propanoate; 2-phenylquinoline; chloride Traditional Name: 2-amino-3-(1-methylimidazol-4-yl)propionic acid methyl ester; iridium; 2-phenylquinoline; chloride Formula: C38H35ClIrN5O2- MolecularWeight: 821.3868

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(N=C1)CC(C(=O)OC)N.C1=CC=C(C=C1)C2=NC3=CC=CC=C3C=C2.C1=CC=C(C=C1)C2=NC3=CC=CC=C3C=C2.[Cl-].[Ir]

Isomeric SMILES

CN1C=C(N=C1)CC(C(=O)OC)N.C1=CC=C(C=C1)C2=NC3=CC=CC=C3C=C2.C1=CC=C(C=C1)C2=NC3=CC=CC=C3C=C2.[Cl-].[Ir]

InChI

InChI=1S/2C15H11N.C8H13N3O2.ClH.Ir/c2*1-2-6-12(7-3-1)15-11-10-13-8-4-5-9-14(13)16-15;1-11-4-6(10-5-11)3-7(9)8(12)13-2;;/h2*1-11H;4-5,7H,3,9H2,1-2H3;1H;/p-1