2-[4-(4-ethylphenyl)-1H-inden-1-id-2-yl]-5-methyl-pyridine; zirconium(2+)

Systemtic Name: 2-[4-(4-ethylphenyl)-1H-inden-1-id-2-yl]-5-methyl-pyridine; zirconium(2+) Openeye Name: 2-[4-(4-ethylphenyl)-1H-inden-1-id-2-yl]-5-methyl-pyridine; zirconium(2+) CAS Name: 2-[4-(4-ethylphenyl)-1H-inden-1-id-2-yl]-5-methylpyridine; zirconium(2+) IUPAC Name: 2-[4-(4-ethylphenyl)-1H-inden-1-id-2-yl]-5-methylpyridine; zirconium(2+) Traditional Name: 2-[4-(4-ethylphenyl)-1H-inden-1-id-2-yl]-5-methyl-pyridine; zirconium(2+) Formula: C46H40N2Zr MolecularWeight: 712.0472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C23H20N.Zr/c2*1-3-17-8-10-18(11-9-17)21-6-4-5-19-13-20(14-22(19)21)23-12-7-16(2)15-24-23;/h2*4-15H,3H2,1-2H3;/q2*-1;+2