2-[[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-oxidanyl-oxolan-2-yl]methoxy]isoindole-1,3-dione

Systemtic Name: 2-[[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-3-oxidanyl-oxolan-2-yl]methoxy]isoindole-1,3-dione Openeye Name: 2-[[5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy]isoindoline-1,3-dione CAS Name: 2-[[5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxy-2-oxolanyl]methoxy]isoindole-1,3-dione IUPAC Name: 2-[[5-(2-amino-6-oxo-3H-purin-9-yl)-3-hydroxyoxolan-2-yl]methoxy]isoindole-1,3-dione Traditional Name: 2-[[5-(2-amino-6-keto-3H-purin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy]isoindoline-1,3-quinone Formula: C18H16N6O6 MolecularWeight: 412.35624

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)CON4C(=O)C5=CC=CC=C5C4=O)O

Isomeric SMILES

C1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)CON4C(=O)C5=CC=CC=C5C4=O)O

InChI

InChI=1S/C18H16N6O6/c19-18-21-14-13(15(26)22-18)20-7-23(14)12-5-10(25)11(30-12)6-29-24-16(27)8-3-1-2-4-9(8)17(24)28/h1-4,7,10-12,25H,5-6H2,(H3,19,21,22,26)