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

Systemtic Name: 2-[3-(6-aminopurin-9-yl)propyl]isoindole-1,3-dione Openeye Name: 2-[3-(6-aminopurin-9-yl)propyl]isoindoline-1,3-dione CAS Name: 2-[3-(6-aminopurin-9-yl)propyl]isoindole-1,3-dione IUPAC Name: 2-[3-(6-aminopurin-9-yl)propyl]isoindole-1,3-dione Traditional Name: 2-(3-adenin-9-ylpropyl)isoindoline-1,3-quinone Formula: C16H14N6O2 MolecularWeight: 322.32136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCN3C=NC4=C3N=CN=C4N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCN3C=NC4=C3N=CN=C4N

InChI

InChI=1S/C16H14N6O2/c17-13-12-14(19-8-18-13)21(9-20-12)6-3-7-22-15(23)10-4-1-2-5-11(10)16(22)24/h1-2,4-5,8-9H,3,6-7H2,(H2,17,18,19)