4-methylbenzoate; zirconium(2+)

Systemtic Name: 4-methylbenzoate; zirconium(2+) Openeye Name: 4-methylbenzoate; zirconium(2+) CAS Name: 4-methylbenzoate; zirconium(2+) IUPAC Name: 4-methylbenzoate; zirconium(2+) Traditional Name: 4-methylbenzoate; zirconium(2+) Formula: C24H21O6Zr- MolecularWeight: 496.64394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)[O-].CC1=CC=C(C=C1)C(=O)[O-].CC1=CC=C(C=C1)C(=O)[O-].[Zr+2]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)[O-].CC1=CC=C(C=C1)C(=O)[O-].CC1=CC=C(C=C1)C(=O)[O-].[Zr+2]

InChI

InChI=1S/3C8H8O2.Zr/c3*1-6-2-4-7(5-3-6)8(9)10;/h3*2-5H,1H3,(H,9,10);/q;;;+2/p-3