[4-[[(3-ethoxycarbonylpyridin-2-yl)-propyl-amino]methyl]phenyl]boronic acid

Systemtic Name: [4-[[(3-ethoxycarbonylpyridin-2-yl)-propyl-amino]methyl]phenyl]boronic acid Openeye Name: [4-[[(3-ethoxycarbonyl-2-pyridyl)-propyl-amino]methyl]phenyl]boronic acid CAS Name: [4-[[(3-ethoxycarbonyl-2-pyridinyl)-propylamino]methyl]phenyl]boronic acid IUPAC Name: [4-[[(3-ethoxycarbonylpyridin-2-yl)-propylamino]methyl]phenyl]boronic acid Traditional Name: [4-[[(3-carbethoxy-2-pyridyl)-propyl-amino]methyl]phenyl]boronic acid Formula: C18H23BN2O4 MolecularWeight: 342.19722

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)CN(CCC)C2=C(C=CC=N2)C(=O)OCC)(O)O

Isomeric SMILES

B(C1=CC=C(C=C1)CN(CCC)C2=C(C=CC=N2)C(=O)OCC)(O)O

InChI

InChI=1S/C18H23BN2O4/c1-3-12-21(13-14-7-9-15(10-8-14)19(23)24)17-16(6-5-11-20-17)18(22)25-4-2/h5-11,23-24H,3-4,12-13H2,1-2H3