cyclopentane; hex-1-ene; 2-phenylethanol; zirconium; perchlorate

Systemtic Name: cyclopentane; hex-1-ene; 2-phenylethanol; zirconium; perchlorate Openeye Name: cyclopentane; hex-1-ene; 2-phenylethanol; zirconium; perchlorate CAS Name: cyclopentane; 1-hexene; 2-phenylethanol; zirconium; perchlorate IUPAC Name: cyclopentane; hex-1-ene; 2-phenylethanol; zirconium; perchlorate Traditional Name: cyclopentane; hex-1-ene; 2-phenylethanol; zirconium; perchlorate Formula: C24H30ClO5Zr- MolecularWeight: 525.169

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=[CH-].C1=CC=C(C=C1)[CH+]CO.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[O-]Cl(=O)(=O)=O.[Zr]

Isomeric SMILES

CCCCC=[CH-].C1=CC=C(C=C1)[CH+]CO.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[O-]Cl(=O)(=O)=O.[Zr]

InChI

InChI=1S/C8H9O.C6H11.2C5H5.ClHO4.Zr/c9-7-6-8-4-2-1-3-5-8;1-3-5-6-4-2;2*1-2-4-5-3-1;2-1(3,4)5;/h1-6,9H,7H2;1,3H,4-6H2,2H3;2*1-5H;(H,2,3,4,5);/q+1;-1;;;;/p-1