[(Z)-3-oxidanyl-1,3-diphenyl-prop-2-enylidene]oxidanium; zirconium

Systemtic Name: [(Z)-3-oxidanyl-1,3-diphenyl-prop-2-enylidene]oxidanium; zirconium Openeye Name: [(Z)-3-hydroxy-1,3-diphenyl-prop-2-enylidene]oxonium; zirconium CAS Name: [(Z)-3-hydroxy-1,3-diphenylprop-2-enylidene]oxonium; zirconium IUPAC Name: [(Z)-3-hydroxy-1,3-diphenylprop-2-enylidene]oxidanium; zirconium Traditional Name: [(Z)-3-hydroxy-1,3-diphenyl-prop-2-enylidene]oxonium; zirconium Formula: C45H39O6Zr+3 MolecularWeight: 767.01156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=CC(=[OH+])C2=CC=CC=C2)O.C1=CC=C(C=C1)C(=CC(=[OH+])C2=CC=CC=C2)O.C1=CC=C(C=C1)C(=CC(=[OH+])C2=CC=CC=C2)O.[Zr]

Isomeric SMILES

C1=CC=C(C=C1)/C(=C/C(=[OH+])C2=CC=CC=C2)/O.C1=CC=C(C=C1)/C(=C/C(=[OH+])C2=CC=CC=C2)/O.C1=CC=C(C=C1)/C(=C/C(=[OH+])C2=CC=CC=C2)/O.[Zr]

InChI

InChI=1S/3C15H12O2.Zr/c3*16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13;/h3*1-11,16H;/p+3/b3*14-11-;