2-[3-(2-azanyl-6-oxidanylidene-3H-purin-7-yl)-2-oxidanyl-propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-(2-azanyl-6-oxidanylidene-3H-purin-7-yl)-2-oxidanyl-propyl]isoindole-1,3-dione Openeye Name: 2-[3-(2-amino-6-oxo-3H-purin-7-yl)-2-hydroxy-propyl]isoindoline-1,3-dione CAS Name: 2-[3-(2-amino-6-oxo-3H-purin-7-yl)-2-hydroxypropyl]isoindole-1,3-dione IUPAC Name: 2-[3-(2-amino-6-oxo-3H-purin-7-yl)-2-hydroxypropyl]isoindole-1,3-dione Traditional Name: 2-[3-(2-amino-6-keto-3H-purin-7-yl)-2-hydroxy-propyl]isoindoline-1,3-quinone Formula: C16H14N6O4 MolecularWeight: 354.32016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(CN3C=NC4=C3C(=O)N=C(N4)N)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC(CN3C=NC4=C3C(=O)N=C(N4)N)O

InChI

InChI=1S/C16H14N6O4/c17-16-19-12-11(13(24)20-16)21(7-18-12)5-8(23)6-22-14(25)9-3-1-2-4-10(9)15(22)26/h1-4,7-8,23H,5-6H2,(H3,17,19,20,24)