N-[1-[2-(5-methoxybenzimidazol-1-yl)quinolin-8-yl]piperidin-4-yl]-methyl-boronamidic acid

Systemtic Name: N-[1-[2-(5-methoxybenzimidazol-1-yl)quinolin-8-yl]piperidin-4-yl]-methyl-boronamidic acid Openeye Name: N-[1-[2-(5-methoxybenzimidazol-1-yl)-8-quinolyl]-4-piperidyl]-methyl-boronamidic acid CAS Name: N-[1-[2-(5-methoxy-1-benzimidazolyl)-8-quinolinyl]-4-piperidinyl]-methylboronamidic acid IUPAC Name: N-[1-[2-(5-methoxybenzimidazol-1-yl)quinolin-8-yl]piperidin-4-yl]-methylboronamidic acid Traditional Name: N-[1-[2-(5-methoxybenzimidazol-1-yl)-8-quinolyl]-4-piperidyl]-methyl-boronamidic acid Formula: C23H26BN5O2 MolecularWeight: 415.29584

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Descriptors Computed from Structure

Canonical SMILES:

B(C)(NC1CCN(CC1)C2=CC=CC3=C2N=C(C=C3)N4C=NC5=C4C=CC(=C5)OC)O

Isomeric SMILES

B(C)(NC1CCN(CC1)C2=CC=CC3=C2N=C(C=C3)N4C=NC5=C4C=CC(=C5)OC)O

InChI

InChI=1S/C23H26BN5O2/c1-24(30)27-17-10-12-28(13-11-17)21-5-3-4-16-6-9-22(26-23(16)21)29-15-25-19-14-18(31-2)7-8-20(19)29/h3-9,14-15,17,27,30H,10-13H2,1-2H3