2-[4-(dihydroxyboranyl)phenyl]-6-methyl-quinoline-4-carboxylic acid

Systemtic Name: 2-[4-(dihydroxyboranyl)phenyl]-6-methyl-quinoline-4-carboxylic acid Openeye Name: 2-(4-boronophenyl)-6-methyl-quinoline-4-carboxylic acid CAS Name: 2-(4-boronophenyl)-6-methyl-4-quinolinecarboxylic acid IUPAC Name: 2-(4-boronophenyl)-6-methylquinoline-4-carboxylic acid Traditional Name: 2-(4-boronophenyl)-6-methyl-cinchoninic acid Formula: C17H14BNO4 MolecularWeight: 307.10836

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)C)C(=C2)C(=O)O)(O)O

Isomeric SMILES

B(C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)C)C(=C2)C(=O)O)(O)O

InChI

InChI=1S/C17H14BNO4/c1-10-2-7-15-13(8-10)14(17(20)21)9-16(19-15)11-3-5-12(6-4-11)18(22)23/h2-9,22-23H,1H3,(H,20,21)