3-oxidanyl-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid; zirconium

Systemtic Name: 3-oxidanyl-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid; zirconium Openeye Name: 7-hydroxytetralin-6-carboxylic acid; zirconium CAS Name: 3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid; zirconium IUPAC Name: 3-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid; zirconium Traditional Name: 7-hydroxytetralin-6-carboxylic acid; zirconium Formula: C22H24O6Zr MolecularWeight: 475.64636

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(C(=C2)O)C(=O)O.C1CCC2=C(C1)C=C(C(=C2)O)C(=O)O.[Zr]

Isomeric SMILES

C1CCC2=C(C1)C=C(C(=C2)O)C(=O)O.C1CCC2=C(C1)C=C(C(=C2)O)C(=O)O.[Zr]

InChI

InChI=1S/2C11H12O3.Zr/c2*12-10-6-8-4-2-1-3-7(8)5-9(10)11(13)14;/h2*5-6,12H,1-4H2,(H,13,14);