[4-[(3-chloranyl-4-methyl-phenyl)carbamoyl]phenyl]boronic acid

Systemtic Name: [4-[(3-chloranyl-4-methyl-phenyl)carbamoyl]phenyl]boronic acid Openeye Name: [4-[(3-chloro-4-methyl-phenyl)carbamoyl]phenyl]boronic acid CAS Name: [4-[(3-chloro-4-methylanilino)-oxomethyl]phenyl]boronic acid IUPAC Name: [4-[(3-chloro-4-methylphenyl)carbamoyl]phenyl]boronic acid Traditional Name: [4-[(3-chloro-4-methyl-phenyl)carbamoyl]phenyl]boronic acid Formula: C14H13BClNO3 MolecularWeight: 289.52192

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)C)Cl)(O)O

Isomeric SMILES

B(C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)C)Cl)(O)O

InChI

InChI=1S/C14H13BClNO3/c1-9-2-7-12(8-13(9)16)17-14(18)10-3-5-11(6-4-10)15(19)20/h2-8,19-20H,1H3,(H,17,18)