[3-methoxy-2-(phenethylcarbamoyl)phenyl]boronic acid

Systemtic Name: [3-methoxy-2-(phenethylcarbamoyl)phenyl]boronic acid Openeye Name: [3-methoxy-2-(phenethylcarbamoyl)phenyl]boronic acid CAS Name: [3-methoxy-2-[oxo-(phenethylamino)methyl]phenyl]boronic acid IUPAC Name: [3-methoxy-2-(phenethylcarbamoyl)phenyl]boronic acid Traditional Name: [3-methoxy-2-(phenethylcarbamoyl)phenyl]boronic acid Formula: C16H18BNO4 MolecularWeight: 299.12942

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=C(C(=CC=C1)OC)C(=O)NCCC2=CC=CC=C2)(O)O

Isomeric SMILES

B(C1=C(C(=CC=C1)OC)C(=O)NCCC2=CC=CC=C2)(O)O

InChI

InChI=1S/C16H18BNO4/c1-22-14-9-5-8-13(17(20)21)15(14)16(19)18-11-10-12-6-3-2-4-7-12/h2-9,20-21H,10-11H2,1H3,(H,18,19)