2-[[5-(hydroxymethyl)furan-2-yl]methylideneamino]-7,9-dihydro-3H-purine-6,8-dione

Systemtic Name: 2-[[5-(hydroxymethyl)furan-2-yl]methylideneamino]-7,9-dihydro-3H-purine-6,8-dione Openeye Name: 2-[[5-(hydroxymethyl)-2-furyl]methyleneamino]-7,9-dihydro-3H-purine-6,8-dione CAS Name: 2-[[5-(hydroxymethyl)-2-furanyl]methylideneamino]-7,9-dihydro-3H-purine-6,8-dione IUPAC Name: 2-[[5-(hydroxymethyl)furan-2-yl]methylideneamino]-7,9-dihydro-3H-purine-6,8-dione Traditional Name: 2-[(5-methylol-2-furyl)methyleneamino]-7,9-dihydro-3H-purine-6,8-quinone Formula: C11H9N5O4 MolecularWeight: 275.22026

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)C=NC2=NC(=O)C3=C(N2)NC(=O)N3)CO

Isomeric SMILES

C1=C(OC(=C1)C=NC2=NC(=O)C3=C(N2)NC(=O)N3)CO

InChI

InChI=1S/C11H9N5O4/c17-4-6-2-1-5(20-6)3-12-10-14-8-7(9(18)16-10)13-11(19)15-8/h1-3,17H,4H2,(H3,13,14,15,16,18,19)