[3-(2-thiophen-2-ylethanoylamino)phenyl]boronic acid

Systemtic Name: [3-(2-thiophen-2-ylethanoylamino)phenyl]boronic acid Openeye Name: [3-[[2-(2-thienyl)acetyl]amino]phenyl]boronic acid CAS Name: [3-[(1-oxo-2-thiophen-2-ylethyl)amino]phenyl]boronic acid IUPAC Name: [3-[(2-thiophen-2-ylacetyl)amino]phenyl]boronic acid Traditional Name: [3-[[2-(2-thienyl)acetyl]amino]phenyl]boronic acid Formula: C12H12BNO3S MolecularWeight: 261.10458

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=CC=C1)NC(=O)CC2=CC=CS2)(O)O

Isomeric SMILES

B(C1=CC(=CC=C1)NC(=O)CC2=CC=CS2)(O)O

InChI

InChI=1S/C12H12BNO3S/c15-12(8-11-5-2-6-18-11)14-10-4-1-3-9(7-10)13(16)17/h1-7,16-17H,8H2,(H,14,15)