2-[3-[6-(2-diphenylboranyloxyethylamino)purin-9-yl]propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[6-(2-diphenylboranyloxyethylamino)purin-9-yl]propyl]isoindole-1,3-dione Openeye Name: 2-[3-[6-(2-diphenylboranyloxyethylamino)purin-9-yl]propyl]isoindoline-1,3-dione CAS Name: 2-[3-[6-(2-diphenylboranyloxyethylamino)-9-purinyl]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-[6-(2-diphenylboranyloxyethylamino)purin-9-yl]propyl]isoindole-1,3-dione Traditional Name: 2-[3-[6-(2-diphenylboranyloxyethylamino)purin-9-yl]propyl]isoindoline-1,3-quinone Formula: C30H27BN6O3 MolecularWeight: 530.38478

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=CC=C1)(C2=CC=CC=C2)OCCNC3=NC=NC4=C3N=CN4CCCN5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

B(C1=CC=CC=C1)(C2=CC=CC=C2)OCCNC3=NC=NC4=C3N=CN4CCCN5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C30H27BN6O3/c38-29-24-14-7-8-15-25(24)30(39)37(29)18-9-17-36-21-35-26-27(33-20-34-28(26)36)32-16-19-40-31(22-10-3-1-4-11-22)23-12-5-2-6-13-23/h1-8,10-15,20-21H,9,16-19H2,(H,32,33,34)