2-[4-(4-ethylphenyl)-1H-inden-1-id-2-yl]pyridine; zirconium(2+)

Systemtic Name: 2-[4-(4-ethylphenyl)-1H-inden-1-id-2-yl]pyridine; zirconium(2+) Openeye Name: 2-[4-(4-ethylphenyl)-1H-inden-1-id-2-yl]pyridine; zirconium(2+) CAS Name: 2-[4-(4-ethylphenyl)-1H-inden-1-id-2-yl]pyridine; zirconium(2+) IUPAC Name: 2-[4-(4-ethylphenyl)-1H-inden-1-id-2-yl]pyridine; zirconium(2+) Traditional Name: 2-[4-(4-ethylphenyl)-1H-inden-1-id-2-yl]pyridine; zirconium(2+) Formula: C44H36N2Zr MolecularWeight: 683.99404

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CC=CC3=C2C=C([CH-]3)C4=CC=CC=N4.CCC1=CC=C(C=C1)C2=CC=CC3=C2C=C([CH-]3)C4=CC=CC=N4.[Zr+2]

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CC=CC3=C2C=C([CH-]3)C4=CC=CC=N4.CCC1=CC=C(C=C1)C2=CC=CC3=C2C=C([CH-]3)C4=CC=CC=N4.[Zr+2]

InChI

InChI=1S/2C22H18N.Zr/c2*1-2-16-9-11-17(12-10-16)20-7-5-6-18-14-19(15-21(18)20)22-8-3-4-13-23-22;/h2*3-15H,2H2,1H3;/q2*-1;+2