2-(5-methylpyridin-2-yl)-6-phenyl-1,3,6,2-dioxazaborocane

Systemtic Name: 2-(5-methylpyridin-2-yl)-6-phenyl-1,3,6,2-dioxazaborocane Openeye Name: 2-(5-methyl-2-pyridyl)-6-phenyl-1,3,6,2-dioxazaborocane CAS Name: 2-(5-methyl-2-pyridinyl)-6-phenyl-1,3,6,2-dioxazaborocane IUPAC Name: 2-(5-methylpyridin-2-yl)-6-phenyl-1,3,6,2-dioxazaborocane Traditional Name: 2-(5-methyl-2-pyridyl)-6-phenyl-1,3,6,2-dioxazaborocane Formula: C16H19BN2O2 MolecularWeight: 282.14526

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Descriptors Computed from Structure

Canonical SMILES:

B1(OCCN(CCO1)C2=CC=CC=C2)C3=NC=C(C=C3)C

Isomeric SMILES

B1(OCCN(CCO1)C2=CC=CC=C2)C3=NC=C(C=C3)C

InChI

InChI=1S/C16H19BN2O2/c1-14-7-8-16(18-13-14)17-20-11-9-19(10-12-21-17)15-5-3-2-4-6-15/h2-8,13H,9-12H2,1H3