4-[bromanyl-(4-phenylphenyl)carbonyl-amino]butylboronic acid

Systemtic Name: 4-[bromanyl-(4-phenylphenyl)carbonyl-amino]butylboronic acid Openeye Name: 4-[bromo-(4-phenylbenzoyl)amino]butylboronic acid CAS Name: 4-[bromo-[oxo-(4-phenylphenyl)methyl]amino]butylboronic acid IUPAC Name: 4-[bromo-(4-phenylbenzoyl)amino]butylboronic acid Traditional Name: 4-[bromo-(4-phenylbenzoyl)amino]butylboronic acid Formula: C17H19BBrNO3 MolecularWeight: 376.05266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(CCCCN(C(=O)C1=CC=C(C=C1)C2=CC=CC=C2)Br)(O)O

Isomeric SMILES

B(CCCCN(C(=O)C1=CC=C(C=C1)C2=CC=CC=C2)Br)(O)O

InChI

InChI=1S/C17H19BBrNO3/c19-20(13-5-4-12-18(22)23)17(21)16-10-8-15(9-11-16)14-6-2-1-3-7-14/h1-3,6-11,22-23H,4-5,12-13H2