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

Systemtic Name: benzene; 2-methyl-3H-cyclopenta[a]naphthalen-3-ide; zirconium(3+) Openeye Name: benzene; 2-methyl-3H-cyclopenta[a]naphthalen-3-ide; zirconium(3+) CAS Name: benzene; 2-methyl-3H-cyclopenta[a]naphthalen-3-ide; zirconium(3+) IUPAC Name: benzene; 2-methyl-3H-cyclopenta[a]naphthalen-3-ide; zirconium(3+) Traditional Name: benzene; 2-methyl-3H-benz[e]inden-3-ide; zirconium(3+) Formula: C26H21Zr MolecularWeight: 424.66894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C([CH-]1)C=CC3=CC=CC=C32.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.[Zr+3]

Isomeric SMILES

CC1=CC2=C([CH-]1)C=CC3=CC=CC=C32.C1=CC=[C-]C=C1.C1=CC=[C-]C=C1.[Zr+3]

InChI

InChI=1S/C14H11.2C6H5.Zr/c1-10-8-12-7-6-11-4-2-3-5-13(11)14(12)9-10;2*1-2-4-6-5-3-1;/h2-9H,1H3;2*1-5H;/q3*-1;+3