1-(4-chlorophenyl)-5-ethyl-2-phenyl-deca-3,4-dien-1-olate; cyclopentane; zirconium(4+)

Systemtic Name: 1-(4-chlorophenyl)-5-ethyl-2-phenyl-deca-3,4-dien-1-olate; cyclopentane; zirconium(4+) Openeye Name: 1-(4-chlorophenyl)-5-ethyl-2-phenyl-deca-3,4-dien-1-olate; cyclopentane; zirconium(4+) CAS Name: 1-(4-chlorophenyl)-5-ethyl-2-phenyl-1-deca-3,4-dienolate; cyclopentane; zirconium(4+) IUPAC Name: 1-(4-chlorophenyl)-5-ethyl-2-phenyldeca-3,4-dien-1-olate; cyclopentane; zirconium(4+) Traditional Name: 1-(4-chlorophenyl)-5-ethyl-2-phenyl-deca-3,4-dien-1-olate; cyclopentane; zirconium(4+) Formula: C34H37ClOZr+2 MolecularWeight: 588.33398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=C=CC(C1=CC=CC=C1)C(C2=CC=C(C=C2)Cl)[O-])C[CH2-].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+4]

Isomeric SMILES

CCCCCC(=C=CC(C1=CC=CC=C1)C(C2=CC=C(C=C2)Cl)[O-])C[CH2-].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Zr+4]

InChI

InChI=1S/C24H27ClO.2C5H5.Zr/c1-3-5-7-10-19(4-2)13-18-23(20-11-8-6-9-12-20)24(26)21-14-16-22(25)17-15-21;2*1-2-4-5-3-1;/h6,8-9,11-12,14-18,23-24H,2-5,7,10H2,1H3;2*1-5H;/q-2;;;+4