1H-inden-1-ide; N-phenyl-3H-inden-3-id-4-amine; zirconium(4+); dichloride

Systemtic Name: 1H-inden-1-ide; N-phenyl-3H-inden-3-id-4-amine; zirconium(4+); dichloride Openeye Name: 1H-inden-1-ide; N-phenyl-3H-inden-3-id-4-amine; zirconium(4+); dichloride CAS Name: 1H-inden-1-ide; N-phenyl-3H-inden-3-id-4-amine; zirconium(4+); dichloride IUPAC Name: 1H-inden-1-ide; N-phenyl-3H-inden-3-id-4-amine; zirconium(4+); dichloride Traditional Name: 1H-inden-1-ide; 3H-inden-3-id-4-yl(phenyl)amine; zirconium(4+); dichloride Formula: C24H19Cl2NZr MolecularWeight: 483.54436

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=C1C(=CC=C2)NC3=CC=CC=C3.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

[CH-]1C=CC2=CC=CC=C21.[CH-]1C=CC2=C1C(=CC=C2)NC3=CC=CC=C3.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C15H12N.C9H7.2ClH.Zr/c1-2-8-13(9-3-1)16-15-11-5-7-12-6-4-10-14(12)15;1-2-5-9-7-3-6-8(9)4-1;;;/h1-11,16H;1-7H;2*1H;/q2*-1;;;+4/p-2