[5-(piperazin-1-ylmethyl)-1-benzothiophen-2-yl]boronic acid

Systemtic Name: [5-(piperazin-1-ylmethyl)-1-benzothiophen-2-yl]boronic acid Openeye Name: [5-(piperazin-1-ylmethyl)benzothiophen-2-yl]boronic acid CAS Name: [5-(1-piperazinylmethyl)-1-benzothiophen-2-yl]boronic acid IUPAC Name: [5-(piperazin-1-ylmethyl)-1-benzothiophen-2-yl]boronic acid Traditional Name: [5-(piperazinomethyl)benzothiophen-2-yl]boronic acid Formula: C13H17BN2O2S MolecularWeight: 276.16228

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC2=C(S1)C=CC(=C2)CN3CCNCC3)(O)O

Isomeric SMILES

B(C1=CC2=C(S1)C=CC(=C2)CN3CCNCC3)(O)O

InChI

InChI=1S/C13H17BN2O2S/c17-14(18)13-8-11-7-10(1-2-12(11)19-13)9-16-5-3-15-4-6-16/h1-2,7-8,15,17-18H,3-6,9H2