tris(5-phenylmethoxy-1H-indol-2-yl) borate

Systemtic Name: tris(5-phenylmethoxy-1H-indol-2-yl) borate Openeye Name: tris(5-benzyloxy-1H-indol-2-yl) borate CAS Name: tris(5-phenylmethoxy-1H-indol-2-yl) borate IUPAC Name: tris(5-phenylmethoxy-1H-indol-2-yl) borate Traditional Name: tris(5-benzoxy-1H-indol-2-yl) borate Formula: C45H36BN3O6 MolecularWeight: 725.59484

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Descriptors Computed from Structure

Canonical SMILES:

B(OC1=CC2=C(N1)C=CC(=C2)OCC3=CC=CC=C3)(OC4=CC5=C(N4)C=CC(=C5)OCC6=CC=CC=C6)OC7=CC8=C(N7)C=CC(=C8)OCC9=CC=CC=C9

Isomeric SMILES

B(OC1=CC2=C(N1)C=CC(=C2)OCC3=CC=CC=C3)(OC4=CC5=C(N4)C=CC(=C5)OCC6=CC=CC=C6)OC7=CC8=C(N7)C=CC(=C8)OCC9=CC=CC=C9

InChI

InChI=1S/C45H36BN3O6/c1-4-10-31(11-5-1)28-50-37-16-19-40-34(22-37)25-43(47-40)53-46(54-44-26-35-23-38(17-20-41(35)48-44)51-29-32-12-6-2-7-13-32)55-45-27-36-24-39(18-21-42(36)49-45)52-30-33-14-8-3-9-15-33/h1-27,47-49H,28-30H2