6-bis(3-chloranyl-4-methyl-phenyl)boranyloxypyridine-2-carboxylic acid

Systemtic Name: 6-bis(3-chloranyl-4-methyl-phenyl)boranyloxypyridine-2-carboxylic acid Openeye Name: 6-bis(3-chloro-4-methyl-phenyl)boranyloxypyridine-2-carboxylic acid CAS Name: 6-bis(3-chloro-4-methylphenyl)boranyloxy-2-pyridinecarboxylic acid IUPAC Name: 6-bis(3-chloro-4-methylphenyl)boranyloxypyridine-2-carboxylic acid Traditional Name: 6-bis(3-chloro-4-methyl-phenyl)boranyloxypicolinic acid Formula: C20H16BCl2NO3 MolecularWeight: 400.06294

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=C(C=C1)C)Cl)(C2=CC(=C(C=C2)C)Cl)OC3=CC=CC(=N3)C(=O)O

Isomeric SMILES

B(C1=CC(=C(C=C1)C)Cl)(C2=CC(=C(C=C2)C)Cl)OC3=CC=CC(=N3)C(=O)O

InChI

InChI=1S/C20H16BCl2NO3/c1-12-6-8-14(10-16(12)22)21(15-9-7-13(2)17(23)11-15)27-19-5-3-4-18(24-19)20(25)26/h3-11H,1-2H3,(H,25,26)