[4-(3-oxidanylidene-3-thiophen-2-yl-propanoyl)phenyl]boronic acid

Systemtic Name: [4-(3-oxidanylidene-3-thiophen-2-yl-propanoyl)phenyl]boronic acid Openeye Name: [4-[3-oxo-3-(2-thienyl)propanoyl]phenyl]boronic acid CAS Name: [4-(1,3-dioxo-3-thiophen-2-ylpropyl)phenyl]boronic acid IUPAC Name: [4-(3-oxo-3-thiophen-2-ylpropanoyl)phenyl]boronic acid Traditional Name: [4-[3-keto-3-(2-thienyl)propanoyl]phenyl]boronic acid Formula: C13H11BO4S MolecularWeight: 274.10004

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)C(=O)CC(=O)C2=CC=CS2)(O)O

Isomeric SMILES

B(C1=CC=C(C=C1)C(=O)CC(=O)C2=CC=CS2)(O)O

InChI

InChI=1S/C13H11BO4S/c15-11(8-12(16)13-2-1-7-19-13)9-3-5-10(6-4-9)14(17)18/h1-7,17-18H,8H2