anthracen-1-ol; zirconium

Systemtic Name: anthracen-1-ol; zirconium Openeye Name: anthracen-1-ol; zirconium CAS Name: 1-anthracenol; zirconium IUPAC Name: anthracen-1-ol; zirconium Traditional Name: 1-anthrol; zirconium Formula: C56H40O4Zr MolecularWeight: 868.1384

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C3C(=CC2=C1)C=CC=C3O.C1=CC=C2C=C3C(=CC2=C1)C=CC=C3O.C1=CC=C2C=C3C(=CC2=C1)C=CC=C3O.C1=CC=C2C=C3C(=CC2=C1)C=CC=C3O.[Zr]

Isomeric SMILES

C1=CC=C2C=C3C(=CC2=C1)C=CC=C3O.C1=CC=C2C=C3C(=CC2=C1)C=CC=C3O.C1=CC=C2C=C3C(=CC2=C1)C=CC=C3O.C1=CC=C2C=C3C(=CC2=C1)C=CC=C3O.[Zr]

InChI

InChI=1S/4C14H10O.Zr/c4*15-14-7-3-6-12-8-10-4-1-2-5-11(10)9-13(12)14;/h4*1-9,15H;