2-[2-[4-(dihydroxyboranyl)phenyl]-2-oxidanylidene-ethyl]sulfanylethanoic acid

Systemtic Name: 2-[2-[4-(dihydroxyboranyl)phenyl]-2-oxidanylidene-ethyl]sulfanylethanoic acid Openeye Name: 2-[2-(4-boronophenyl)-2-oxo-ethyl]sulfanylacetic acid CAS Name: 2-[[2-(4-boronophenyl)-2-oxoethyl]thio]acetic acid IUPAC Name: 2-[2-(4-boronophenyl)-2-oxoethyl]sulfanylacetic acid Traditional Name: 2-[[2-(4-boronophenyl)-2-keto-ethyl]thio]acetic acid Formula: C10H11BO5S MolecularWeight: 254.06734

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)C(=O)CSCC(=O)O)(O)O

Isomeric SMILES

B(C1=CC=C(C=C1)C(=O)CSCC(=O)O)(O)O

InChI

InChI=1S/C10H11BO5S/c12-9(5-17-6-10(13)14)7-1-3-8(4-2-7)11(15)16/h1-4,15-16H,5-6H2,(H,13,14)