6-(2-phenylpropan-2-yl)naphthalene-2,3-diol; zirconium

Systemtic Name: 6-(2-phenylpropan-2-yl)naphthalene-2,3-diol; zirconium Openeye Name: 6-(1-methyl-1-phenyl-ethyl)naphthalene-2,3-diol; zirconium CAS Name: 6-(2-phenylpropan-2-yl)naphthalene-2,3-diol; zirconium IUPAC Name: 6-(2-phenylpropan-2-yl)naphthalene-2,3-diol; zirconium Traditional Name: 6-cumylnaphthalene-2,3-diol; zirconium Formula: C38H36O4Zr MolecularWeight: 647.91404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC3=CC(=C(C=C3C=C2)O)O.CC(C)(C1=CC=CC=C1)C2=CC3=CC(=C(C=C3C=C2)O)O.[Zr]

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC3=CC(=C(C=C3C=C2)O)O.CC(C)(C1=CC=CC=C1)C2=CC3=CC(=C(C=C3C=C2)O)O.[Zr]

InChI

InChI=1S/2C19H18O2.Zr/c2*1-19(2,15-6-4-3-5-7-15)16-9-8-13-11-17(20)18(21)12-14(13)10-16;/h2*3-12,20-21H,1-2H3;