methyl-[4-[[6-(phenylsulfonyl)pyridin-3-yl]methyl]piperidin-1-yl]borinic acid

Systemtic Name: methyl-[4-[[6-(phenylsulfonyl)pyridin-3-yl]methyl]piperidin-1-yl]borinic acid Openeye Name: [4-[[6-(benzenesulfonyl)-3-pyridyl]methyl]-1-piperidyl]-methyl-borinic acid CAS Name: [4-[[6-(benzenesulfonyl)-3-pyridinyl]methyl]-1-piperidinyl]-methylborinic acid IUPAC Name: [4-[[6-(benzenesulfonyl)pyridin-3-yl]methyl]piperidin-1-yl]-methylborinic acid Traditional Name: [4-[(6-besyl-3-pyridyl)methyl]piperidino]-methyl-borinic acid Formula: C18H23BN2O3S MolecularWeight: 358.26282

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Descriptors Computed from Structure

Canonical SMILES:

B(C)(N1CCC(CC1)CC2=CN=C(C=C2)S(=O)(=O)C3=CC=CC=C3)O

Isomeric SMILES

B(C)(N1CCC(CC1)CC2=CN=C(C=C2)S(=O)(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C18H23BN2O3S/c1-19(22)21-11-9-15(10-12-21)13-16-7-8-18(20-14-16)25(23,24)17-5-3-2-4-6-17/h2-8,14-15,22H,9-13H2,1H3