[3-methoxycarbonyl-5-(2-phenylethanoylamino)phenyl]boronic acid

Systemtic Name: [3-methoxycarbonyl-5-(2-phenylethanoylamino)phenyl]boronic acid Openeye Name: [3-methoxycarbonyl-5-[(2-phenylacetyl)amino]phenyl]boronic acid CAS Name: [3-methoxycarbonyl-5-[(1-oxo-2-phenylethyl)amino]phenyl]boronic acid IUPAC Name: [3-methoxycarbonyl-5-[(2-phenylacetyl)amino]phenyl]boronic acid Traditional Name: [3-carbomethoxy-5-[(2-phenylacetyl)amino]phenyl]boronic acid Formula: C16H16BNO5 MolecularWeight: 313.11294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16BNO5/c1-23-16(20)12-8-13(17(21)22)10-14(9-12)18-15(19)7-11-5-3-2-4-6-11/h2-6,8-10,21-22H,7H2,1H3,(H,18,19)