[5-(phenylmethoxycarbonylaminomethyl)thiophen-2-yl]boronic acid

Systemtic Name: [5-(phenylmethoxycarbonylaminomethyl)thiophen-2-yl]boronic acid Openeye Name: [5-(benzyloxycarbonylaminomethyl)-2-thienyl]boronic acid CAS Name: [5-(phenylmethoxycarbonylaminomethyl)-2-thiophenyl]boronic acid IUPAC Name: [5-(phenylmethoxycarbonylaminomethyl)thiophen-2-yl]boronic acid Traditional Name: [5-(benzyloxycarbonylaminomethyl)-2-thienyl]boronic acid Formula: C13H14BNO4S MolecularWeight: 291.13056

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(S1)CNC(=O)OCC2=CC=CC=C2)(O)O

Isomeric SMILES

B(C1=CC=C(S1)CNC(=O)OCC2=CC=CC=C2)(O)O

InChI

InChI=1S/C13H14BNO4S/c16-13(19-9-10-4-2-1-3-5-10)15-8-11-6-7-12(20-11)14(17)18/h1-7,17-18H,8-9H2,(H,15,16)