1,3,7,9-tetratert-butyl-11-phenyl-5H-benzo[d][1,3,2]benzodioxaborocine

Systemtic Name: 1,3,7,9-tetratert-butyl-11-phenyl-5H-benzo[d][1,3,2]benzodioxaborocine Openeye Name: 1,3,7,9-tetratert-butyl-11-phenyl-5H-benzo[d][1,3,2]benzodioxaborocine CAS Name: 1,3,7,9-tetratert-butyl-11-phenyl-5H-benzo[d][1,3,2]benzodioxaborocin IUPAC Name: 1,3,7,9-tetratert-butyl-11-phenyl-5H-benzo[d][1,3,2]benzodioxaborocine Traditional Name: 1,3,7,9-tetratert-butyl-11-phenyl-5H-benzo[d][1,3,2]benzodioxaborocin Formula: C35H47BO2 MolecularWeight: 510.55748

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Descriptors Computed from Structure

Canonical SMILES:

B1(OC2=C(C=C(C=C2CC3=CC(=CC(=C3O1)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C)C4=CC=CC=C4

Isomeric SMILES

B1(OC2=C(C=C(C=C2CC3=CC(=CC(=C3O1)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C)C4=CC=CC=C4

InChI

InChI=1S/C35H47BO2/c1-32(2,3)25-19-23-18-24-20-26(33(4,5)6)22-29(35(10,11)12)31(24)38-36(27-16-14-13-15-17-27)37-30(23)28(21-25)34(7,8)9/h13-17,19-22H,18H2,1-12H3