carbanide; 5-chloranyl-2-oxidanyl-benzoic acid; zirconium

Systemtic Name: carbanide; 5-chloranyl-2-oxidanyl-benzoic acid; zirconium Openeye Name: carbanide; 5-chloro-2-hydroxy-benzoic acid; zirconium CAS Name: carbanide; 5-chloro-2-hydroxybenzoic acid; zirconium IUPAC Name: carbanide; 5-chloro-2-hydroxybenzoic acid; zirconium Traditional Name: carbanide; 5-chloro-2-hydroxy-benzoic acid; zirconium Formula: C22H18Cl3O9Zr- MolecularWeight: 623.95592

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].C1=CC(=C(C=C1Cl)C(=O)O)O.C1=CC(=C(C=C1Cl)C(=O)O)O.C1=CC(=C(C=C1Cl)C(=O)O)O.[Zr]

Isomeric SMILES

[CH3-].C1=CC(=C(C=C1Cl)C(=O)O)O.C1=CC(=C(C=C1Cl)C(=O)O)O.C1=CC(=C(C=C1Cl)C(=O)O)O.[Zr]

InChI

InChI=1S/3C7H5ClO3.CH3.Zr/c3*8-4-1-2-6(9)5(3-4)7(10)11;;/h3*1-3,9H,(H,10,11);1H3;/q;;;-1;