[3-(3-phenylpropylcarbamoyl)phenyl]boronic acid

Systemtic Name: [3-(3-phenylpropylcarbamoyl)phenyl]boronic acid Openeye Name: [3-(3-phenylpropylcarbamoyl)phenyl]boronic acid CAS Name: [3-[oxo-(3-phenylpropylamino)methyl]phenyl]boronic acid IUPAC Name: [3-(3-phenylpropylcarbamoyl)phenyl]boronic acid Traditional Name: [3-(3-phenylpropylcarbamoyl)phenyl]boronic acid Formula: C16H18BNO3 MolecularWeight: 283.13002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=CC=C1)C(=O)NCCCC2=CC=CC=C2)(O)O

Isomeric SMILES

B(C1=CC(=CC=C1)C(=O)NCCCC2=CC=CC=C2)(O)O

InChI

InChI=1S/C16H18BNO3/c19-16(14-9-4-10-15(12-14)17(20)21)18-11-5-8-13-6-2-1-3-7-13/h1-4,6-7,9-10,12,20-21H,5,8,11H2,(H,18,19)