6-methyl-2-(4-methylphenyl)-1,3,6,2-dioxazaborocane

Systemtic Name: 6-methyl-2-(4-methylphenyl)-1,3,6,2-dioxazaborocane Openeye Name: 6-methyl-2-(p-tolyl)-1,3,6,2-dioxazaborocane CAS Name: 6-methyl-2-(4-methylphenyl)-1,3,6,2-dioxazaborocane IUPAC Name: 6-methyl-2-(4-methylphenyl)-1,3,6,2-dioxazaborocane Traditional Name: 6-methyl-2-(p-tolyl)-1,3,6,2-dioxazaborocane Formula: C12H18BNO2 MolecularWeight: 219.08782

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18BNO2/c1-11-3-5-12(6-4-11)13-15-9-7-14(2)8-10-16-13/h3-6H,7-10H2,1-2H3