6-[(E)-octadec-9-enyl]-2-oxidanyl-4,8-diphenyl-1,3,6,2-dioxazaborocane

Systemtic Name: 6-[(E)-octadec-9-enyl]-2-oxidanyl-4,8-diphenyl-1,3,6,2-dioxazaborocane Openeye Name: 2-hydroxy-6-[(E)-octadec-9-enyl]-4,8-diphenyl-1,3,6,2-dioxazaborocane CAS Name: 2-hydroxy-6-[(E)-octadec-9-enyl]-4,8-diphenyl-1,3,6,2-dioxazaborocane IUPAC Name: 2-hydroxy-6-[(E)-octadec-9-enyl]-4,8-diphenyl-1,3,6,2-dioxazaborocane Traditional Name: 2-hydroxy-6-[(E)-octadec-9-enyl]-4,8-diphenyl-1,3,6,2-dioxazaborocane Formula: C34H52BNO3 MolecularWeight: 533.59258

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Descriptors Computed from Structure

Canonical SMILES:

B1(OC(CN(CC(O1)C2=CC=CC=C2)CCCCCCCCC=CCCCCCCCC)C3=CC=CC=C3)O

Isomeric SMILES

B1(OC(CN(CC(O1)C2=CC=CC=C2)CCCCCCCC/C=C/CCCCCCCC)C3=CC=CC=C3)O

InChI

InChI=1S/C34H52BNO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-28-36-29-33(31-24-19-17-20-25-31)38-35(37)39-34(30-36)32-26-21-18-22-27-32/h9-10,17-22,24-27,33-34,37H,2-8,11-16,23,28-30H2,1H3/b10-9+