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

Systemtic Name: [3-chloranyl-4-[(phenylmethyl)carbamoyl]phenyl]boronic acid Openeye Name: [4-(benzylcarbamoyl)-3-chloro-phenyl]boronic acid CAS Name: [3-chloro-4-[oxo-[(phenylmethyl)amino]methyl]phenyl]boronic acid IUPAC Name: [4-(benzylcarbamoyl)-3-chlorophenyl]boronic acid Traditional Name: [4-(benzylcarbamoyl)-3-chloro-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)NCC2=CC=CC=C2)Cl)(O)O

Isomeric SMILES

B(C1=CC(=C(C=C1)C(=O)NCC2=CC=CC=C2)Cl)(O)O

InChI

InChI=1S/C14H13BClNO3/c16-13-8-11(15(19)20)6-7-12(13)14(18)17-9-10-4-2-1-3-5-10/h1-8,19-20H,9H2,(H,17,18)