2-(1H-inden-1-id-2-yl)-1-methyl-5-propyl-pyrrole; zirconium(4+); dichloride

Systemtic Name: 2-(1H-inden-1-id-2-yl)-1-methyl-5-propyl-pyrrole; zirconium(4+); dichloride Openeye Name: 2-(1H-inden-1-id-2-yl)-1-methyl-5-propyl-pyrrole; zirconium(4+); dichloride CAS Name: 2-(1H-inden-1-id-2-yl)-1-methyl-5-propylpyrrole; zirconium(4+); dichloride IUPAC Name: 2-(1H-inden-1-id-2-yl)-1-methyl-5-propylpyrrole; zirconium(4+); dichloride Traditional Name: 2-(1H-inden-1-id-2-yl)-1-methyl-5-propyl-pyrrole; zirconium(4+); dichloride Formula: C34H36Cl2N2Zr MolecularWeight: 634.79304

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(N1C)C2=CC3=CC=CC=C3[CH-]2.CCCC1=CC=C(N1C)C2=CC3=CC=CC=C3[CH-]2.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CCCC1=CC=C(N1C)C2=CC3=CC=CC=C3[CH-]2.CCCC1=CC=C(N1C)C2=CC3=CC=CC=C3[CH-]2.[Cl-].[Cl-].[Zr+4]

InChI

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