[4-(2-acetamido-3-ethanoylsulfanyl-propoxy)phenyl]boron

Systemtic Name: [4-(2-acetamido-3-ethanoylsulfanyl-propoxy)phenyl]boron Openeye Name: [4-(2-acetamido-3-acetylsulfanyl-propoxy)phenyl]boron CAS Name: [4-[2-acetamido-3-(acetylthio)propoxy]phenyl]boron IUPAC Name: [4-(2-acetamido-3-acetylsulfanylpropoxy)phenyl]boron Traditional Name: [4-[2-acetamido-3-(acetylthio)propoxy]phenyl]boron Formula: C13H16BNO3S MolecularWeight: 277.14704

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Descriptors Computed from Structure

Canonical SMILES:

[B]C1=CC=C(C=C1)OCC(CSC(=O)C)NC(=O)C

Isomeric SMILES

[B]C1=CC=C(C=C1)OCC(CSC(=O)C)NC(=O)C

InChI

InChI=1S/C13H16BNO3S/c1-9(16)15-12(8-19-10(2)17)7-18-13-5-3-11(14)4-6-13/h3-6,12H,7-8H2,1-2H3,(H,15,16)