2-(2-methylpropoxy)-6-[(1-oxidanyl-3H-2,1-benzoxaborol-5-yl)amino]pyridine-3-carbonitrile

Systemtic Name: 2-(2-methylpropoxy)-6-[(1-oxidanyl-3H-2,1-benzoxaborol-5-yl)amino]pyridine-3-carbonitrile Openeye Name: 6-[(1-hydroxy-3H-2,1-benzoxaborol-5-yl)amino]-2-isobutoxy-pyridine-3-carbonitrile CAS Name: 6-[(1-hydroxy-3H-2,1-benzoxaborol-5-yl)amino]-2-(2-methylpropoxy)-3-pyridinecarbonitrile IUPAC Name: 6-[(1-hydroxy-3H-2,1-benzoxaborol-5-yl)amino]-2-(2-methylpropoxy)pyridine-3-carbonitrile Traditional Name: 6-[(1-hydroxy-3H-2,1-benzoxaborol-5-yl)amino]-2-isobutoxy-nicotinonitrile Formula: C17H18BN3O3 MolecularWeight: 323.15412

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Descriptors Computed from Structure

Canonical SMILES:

B1(C2=C(CO1)C=C(C=C2)NC3=NC(=C(C=C3)C#N)OCC(C)C)O

Isomeric SMILES

B1(C2=C(CO1)C=C(C=C2)NC3=NC(=C(C=C3)C#N)OCC(C)C)O

InChI

InChI=1S/C17H18BN3O3/c1-11(2)9-23-17-12(8-19)3-6-16(21-17)20-14-4-5-15-13(7-14)10-24-18(15)22/h3-7,11,22H,9-10H2,1-2H3,(H,20,21)