N-[2-(ethylsulfanylmethyl)-4-methyl-phenyl]-methyl-boronamidic acid

Systemtic Name: N-[2-(ethylsulfanylmethyl)-4-methyl-phenyl]-methyl-boronamidic acid Openeye Name: N-[2-(ethylsulfanylmethyl)-4-methyl-phenyl]-methyl-boronamidic acid CAS Name: N-[2-[(ethylthio)methyl]-4-methylphenyl]-methylboronamidic acid IUPAC Name: N-[2-(ethylsulfanylmethyl)-4-methylphenyl]-methylboronamidic acid Traditional Name: N-[2-[(ethylthio)methyl]-4-methyl-phenyl]-methyl-boronamidic acid Formula: C11H18BNOS MolecularWeight: 223.14272

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Descriptors Computed from Structure

Canonical SMILES:

B(C)(NC1=C(C=C(C=C1)C)CSCC)O

Isomeric SMILES

B(C)(NC1=C(C=C(C=C1)C)CSCC)O

InChI

InChI=1S/C11H18BNOS/c1-4-15-8-10-7-9(2)5-6-11(10)13-12(3)14/h5-7,13-14H,4,8H2,1-3H3