2-azanyl-9-[5-[2-(4-nitrophenyl)ethoxymethyl]-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[5-[2-(4-nitrophenyl)ethoxymethyl]-4-oxidanyl-oxolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[4-hydroxy-5-[2-(4-nitrophenyl)ethoxymethyl]tetrahydrofuran-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[4-hydroxy-5-[2-(4-nitrophenyl)ethoxymethyl]-2-oxolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[4-hydroxy-5-[2-(4-nitrophenyl)ethoxymethyl]oxolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[4-hydroxy-5-[2-(4-nitrophenyl)ethoxymethyl]tetrahydrofuran-2-yl]-3H-purin-6-one Formula: C18H20N6O6 MolecularWeight: 416.388

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)COCCC4=CC=C(C=C4)[N+](=O)[O-])O

Isomeric SMILES

C1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)COCCC4=CC=C(C=C4)[N+](=O)[O-])O

InChI

InChI=1S/C18H20N6O6/c19-18-21-16-15(17(26)22-18)20-9-23(16)14-7-12(25)13(30-14)8-29-6-5-10-1-3-11(4-2-10)24(27)28/h1-4,9,12-14,25H,5-8H2,(H3,19,21,22,26)