3H-cyclopenta[a]naphthalen-3-ide; 2-methyl-3H-cyclopenta[a]naphthalen-3-ide; zirconium(4+); dichloride

Systemtic Name: 3H-cyclopenta[a]naphthalen-3-ide; 2-methyl-3H-cyclopenta[a]naphthalen-3-ide; zirconium(4+); dichloride Openeye Name: 3H-cyclopenta[a]naphthalen-3-ide; 2-methyl-3H-cyclopenta[a]naphthalen-3-ide; zirconium(4+); dichloride CAS Name: 3H-cyclopenta[a]naphthalen-3-ide; 2-methyl-3H-cyclopenta[a]naphthalen-3-ide; zirconium(4+); dichloride IUPAC Name: 3H-cyclopenta[a]naphthalen-3-ide; 2-methyl-3H-cyclopenta[a]naphthalen-3-ide; zirconium(4+); dichloride Traditional Name: 3H-benz[e]inden-3-ide; 2-methyl-3H-benz[e]inden-3-ide; zirconium(4+); dichloride Formula: C27H20Cl2Zr MolecularWeight: 506.5777

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C([CH-]1)C=CC3=CC=CC=C32.[CH-]1C=CC2=C1C=CC3=CC=CC=C32.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CC1=CC2=C([CH-]1)C=CC3=CC=CC=C32.[CH-]1C=CC2=C1C=CC3=CC=CC=C32.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C14H11.C13H9.2ClH.Zr/c1-10-8-12-7-6-11-4-2-3-5-13(11)14(12)9-10;1-2-6-12-10(4-1)8-9-11-5-3-7-13(11)12;;;/h2-9H,1H3;1-9H;2*1H;/q2*-1;;;+4/p-2