3-(dihydroxyboranyl)-5-(2-phenylethanoylamino)benzoic acid

Systemtic Name: 3-(dihydroxyboranyl)-5-(2-phenylethanoylamino)benzoic acid Openeye Name: 3-borono-5-[(2-phenylacetyl)amino]benzoic acid CAS Name: 3-borono-5-[(1-oxo-2-phenylethyl)amino]benzoic acid IUPAC Name: 3-borono-5-[(2-phenylacetyl)amino]benzoic acid Traditional Name: 3-borono-5-[(2-phenylacetyl)amino]benzoic acid Formula: C15H14BNO5 MolecularWeight: 299.08636

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=CC(=C1)NC(=O)CC2=CC=CC=C2)C(=O)O)(O)O

Isomeric SMILES

B(C1=CC(=CC(=C1)NC(=O)CC2=CC=CC=C2)C(=O)O)(O)O

InChI

InChI=1S/C15H14BNO5/c18-14(6-10-4-2-1-3-5-10)17-13-8-11(15(19)20)7-12(9-13)16(21)22/h1-5,7-9,21-22H,6H2,(H,17,18)(H,19,20)