methyl-[3-[(4-methylphenyl)sulfonyloxymethyl]-5-oxidanylidene-piperidin-1-yl]borinic acid

Systemtic Name: methyl-[3-[(4-methylphenyl)sulfonyloxymethyl]-5-oxidanylidene-piperidin-1-yl]borinic acid Openeye Name: methyl-[3-oxo-5-(p-tolylsulfonyloxymethyl)-1-piperidyl]borinic acid CAS Name: methyl-[3-[(4-methylphenyl)sulfonyloxymethyl]-5-oxo-1-piperidinyl]borinic acid IUPAC Name: methyl-[3-[(4-methylphenyl)sulfonyloxymethyl]-5-oxopiperidin-1-yl]borinic acid Traditional Name: [3-keto-5-(tosyloxymethyl)piperidino]-methyl-borinic acid Formula: C14H20BNO5S MolecularWeight: 325.1883

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Descriptors Computed from Structure

Canonical SMILES:

B(C)(N1CC(CC(=O)C1)COS(=O)(=O)C2=CC=C(C=C2)C)O

Isomeric SMILES

B(C)(N1CC(CC(=O)C1)COS(=O)(=O)C2=CC=C(C=C2)C)O

InChI

InChI=1S/C14H20BNO5S/c1-11-3-5-14(6-4-11)22(19,20)21-10-12-7-13(17)9-16(8-12)15(2)18/h3-6,12,18H,7-10H2,1-2H3