4-(3,5-dimethylphenyl)-2-methyl-1H-inden-1-ide; 2-methylbuta-1,3-diene; zirconium(2+)

Systemtic Name: 4-(3,5-dimethylphenyl)-2-methyl-1H-inden-1-ide; 2-methylbuta-1,3-diene; zirconium(2+) Openeye Name: 4-(3,5-dimethylphenyl)-2-methyl-1H-inden-1-ide; isoprene; zirconium(2+) CAS Name: 4-(3,5-dimethylphenyl)-2-methyl-1H-inden-1-ide; 2-methylbuta-1,3-diene; zirconium(2+) IUPAC Name: 4-(3,5-dimethylphenyl)-2-methyl-1H-inden-1-ide; 2-methylbuta-1,3-diene; zirconium(2+) Traditional Name: 4-(3,5-dimethylphenyl)-2-methyl-1H-inden-1-ide; isoprene; zirconium(2+) Formula: C23H25Zr+ MolecularWeight: 392.6686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C([CH-]1)C=CC=C2C3=CC(=CC(=C3)C)C.CC(=C)C=C.[Zr+2]

Isomeric SMILES

CC1=CC2=C([CH-]1)C=CC=C2C3=CC(=CC(=C3)C)C.CC(=C)C=C.[Zr+2]

InChI

InChI=1S/C18H17.C5H8.Zr/c1-12-7-13(2)10-16(9-12)17-6-4-5-15-8-14(3)11-18(15)17;1-4-5(2)3;/h4-11H,1-3H3;4H,1-2H2,3H3;/q-1;;+2