2-(4-ethyl-1H-inden-1-id-2-yl)-1,5-dimethyl-pyrrole; zirconium(4+); dichloride

Systemtic Name: 2-(4-ethyl-1H-inden-1-id-2-yl)-1,5-dimethyl-pyrrole; zirconium(4+); dichloride Openeye Name: 2-(4-ethyl-1H-inden-1-id-2-yl)-1,5-dimethyl-pyrrole; zirconium(4+); dichloride CAS Name: 2-(4-ethyl-1H-inden-1-id-2-yl)-1,5-dimethylpyrrole; zirconium(4+); dichloride IUPAC Name: 2-(4-ethyl-1H-inden-1-id-2-yl)-1,5-dimethylpyrrole; zirconium(4+); dichloride Traditional Name: 2-(4-ethyl-1H-inden-1-id-2-yl)-1,5-dimethyl-pyrrole; zirconium(4+); dichloride Formula: C34H36Cl2N2Zr MolecularWeight: 634.79304

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1C=C([CH-]2)C3=CC=C(N3C)C.CCC1=CC=CC2=C1C=C([CH-]2)C3=CC=C(N3C)C.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CCC1=CC=CC2=C1C=C([CH-]2)C3=CC=C(N3C)C.CCC1=CC=CC2=C1C=C([CH-]2)C3=CC=C(N3C)C.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/2C17H18N.2ClH.Zr/c2*1-4-13-6-5-7-14-10-15(11-16(13)14)17-9-8-12(2)18(17)3;;;/h2*5-11H,4H2,1-3H3;2*1H;/q2*-1;;;+4/p-2