2-methyl-4-phenyl-1,2,3,4,5,6-hexahydroazulen-1-ide; zirconium(2+); dichloride

Systemtic Name: 2-methyl-4-phenyl-1,2,3,4,5,6-hexahydroazulen-1-ide; zirconium(2+); dichloride Openeye Name: 2-methyl-4-phenyl-1,2,3,4,5,6-hexahydroazulen-1-ide; zirconium(2+); dichloride CAS Name: 2-methyl-4-phenyl-1,2,3,4,5,6-hexahydroazulen-1-ide; zirconium(2+); dichloride IUPAC Name: 2-methyl-4-phenyl-1,2,3,4,5,6-hexahydroazulen-1-ide; zirconium(2+); dichloride Traditional Name: 2-methyl-4-phenyl-1,2,3,4,5,6-hexahydroazulen-1-ide; zirconium(2+); dichloride Formula: C17H19Cl2Zr- MolecularWeight: 385.46276

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C([CH-]1)C=CCCC2C3=CC=CC=C3.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CC1CC2=C([CH-]1)C=CCCC2C3=CC=CC=C3.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/C17H19.2ClH.Zr/c1-13-11-15-9-5-6-10-16(17(15)12-13)14-7-3-2-4-8-14;;;/h2-5,7-9,11,13,16H,6,10,12H2,1H3;2*1H;/q-1;;;+2/p-2