aluminum; 5-(4-chloranylphenoxy)pyridine-2-carboxylic acid; hydrate

Systemtic Name: aluminum; 5-(4-chloranylphenoxy)pyridine-2-carboxylic acid; hydrate Openeye Name: aluminum; 5-(4-chlorophenoxy)pyridine-2-carboxylic acid; hydrate CAS Name: aluminum; 5-(4-chlorophenoxy)-2-pyridinecarboxylic acid; hydrate IUPAC Name: aluminum; 5-(4-chlorophenoxy)pyridine-2-carboxylic acid; hydrate Traditional Name: aluminum; 5-(4-chlorophenoxy)picolinic acid; hydrate Formula: C24H18AlCl2N2O7 MolecularWeight: 544.296458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC2=CN=C(C=C2)C(=O)O)Cl.C1=CC(=CC=C1OC2=CN=C(C=C2)C(=O)O)Cl.O.[Al]

Isomeric SMILES

C1=CC(=CC=C1OC2=CN=C(C=C2)C(=O)O)Cl.C1=CC(=CC=C1OC2=CN=C(C=C2)C(=O)O)Cl.O.[Al]

InChI

InChI=1S/2C12H8ClNO3.Al.H2O/c2*13-8-1-3-9(4-2-8)17-10-5-6-11(12(15)16)14-7-10;;/h2*1-7H,(H,15,16);;1H2