methanidylbenzene; prop-2-en-1-ol; zirconium(3+)

Systemtic Name: methanidylbenzene; prop-2-en-1-ol; zirconium(3+) Openeye Name: methanidylbenzene; prop-2-en-1-ol; zirconium(3+) CAS Name: methanidylbenzene; 2-propen-1-ol; zirconium(3+) IUPAC Name: methanidylbenzene; prop-2-en-1-ol; zirconium(3+) Traditional Name: methanidylbenzene; prop-2-en-1-ol; zirconium(3+) Formula: C24H27OZr MolecularWeight: 422.69458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3C7H7.C3H6O.Zr/c3*1-7-5-3-2-4-6-7;1-2-3-4;/h3*2-6H,1H2;2,4H,1,3H2;/q3*-1;;+3