6-butyl-2-phenyl-1,3,6,2-dioxazaborocane

Systemtic Name: 6-butyl-2-phenyl-1,3,6,2-dioxazaborocane Openeye Name: 6-butyl-2-phenyl-1,3,6,2-dioxazaborocane CAS Name: 6-butyl-2-phenyl-1,3,6,2-dioxazaborocane IUPAC Name: 6-butyl-2-phenyl-1,3,6,2-dioxazaborocane Traditional Name: 6-butyl-2-phenyl-1,3,6,2-dioxazaborocane Formula: C14H22BNO2 MolecularWeight: 247.14098

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22BNO2/c1-2-3-9-16-10-12-17-15(18-13-11-16)14-7-5-4-6-8-14/h4-8H,2-3,9-13H2,1H3