ethanol; methanidylbenzene; zirconium(3+)

Systemtic Name: ethanol; methanidylbenzene; zirconium(3+) Openeye Name: ethanol; methanidylbenzene; zirconium(3+) CAS Name: ethanol; methanidylbenzene; zirconium(3+) IUPAC Name: ethanol; methanidylbenzene; zirconium(3+) Traditional Name: ethanol; methanidylbenzene; zirconium(3+) Formula: C23H27OZr MolecularWeight: 410.68388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCO.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[Zr+3]

Isomeric SMILES

CCO.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[CH2-]C1=CC=CC=C1.[Zr+3]

InChI

InChI=1S/3C7H7.C2H6O.Zr/c3*1-7-5-3-2-4-6-7;1-2-3;/h3*2-6H,1H2;3H,2H2,1H3;/q3*-1;;+3