methyl-[4-(oxidanylcarbamoyl)-4-(4-phenoxyphenyl)sulfonyl-piperidin-1-yl]borinic acid

Systemtic Name: methyl-[4-(oxidanylcarbamoyl)-4-(4-phenoxyphenyl)sulfonyl-piperidin-1-yl]borinic acid Openeye Name: [4-(hydroxycarbamoyl)-4-(4-phenoxyphenyl)sulfonyl-1-piperidyl]-methyl-borinic acid CAS Name: [4-[(hydroxyamino)-oxomethyl]-4-(4-phenoxyphenyl)sulfonyl-1-piperidinyl]-methylborinic acid IUPAC Name: [4-(hydroxycarbamoyl)-4-(4-phenoxyphenyl)sulfonylpiperidin-1-yl]-methylborinic acid Traditional Name: [4-(hydroxycarbamoyl)-4-(4-phenoxyphenyl)sulfonyl-piperidino]-methyl-borinic acid Formula: C19H23BN2O6S MolecularWeight: 418.27172

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Descriptors Computed from Structure

Canonical SMILES:

B(C)(N1CCC(CC1)(C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)O

Isomeric SMILES

B(C)(N1CCC(CC1)(C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)O

InChI

InChI=1S/C19H23BN2O6S/c1-20(24)22-13-11-19(12-14-22,18(23)21-25)29(26,27)17-9-7-16(8-10-17)28-15-5-3-2-4-6-15/h2-10,24-25H,11-14H2,1H3,(H,21,23)