2-methyl-1H-inden-1-ide; methylsulfanylmethane; zirconium(4+); dichloride

Systemtic Name: 2-methyl-1H-inden-1-ide; methylsulfanylmethane; zirconium(4+); dichloride Openeye Name: 2-methyl-1H-inden-1-ide; methylsulfanylmethane; zirconium(4+); dichloride CAS Name: 2-methyl-1H-inden-1-ide; (methylthio)methane; zirconium(4+); dichloride IUPAC Name: 2-methyl-1H-inden-1-ide; methylsulfanylmethane; zirconium(4+); dichloride Traditional Name: 2-methyl-1H-inden-1-ide; (methylthio)methane; zirconium(4+); dichloride Formula: C22H24Cl2SZr MolecularWeight: 482.62096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2[CH-]1.CC1=CC2=CC=CC=C2[CH-]1.CSC.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CC1=CC2=CC=CC=C2[CH-]1.CC1=CC2=CC=CC=C2[CH-]1.CSC.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/2C10H9.C2H6S.2ClH.Zr/c2*1-8-6-9-4-2-3-5-10(9)7-8;1-3-2;;;/h2*2-7H,1H3;1-2H3;2*1H;/q2*-1;;;;+4/p-2