4-(2-azanyl-4-oxidanylidene-3H-furo[2,3-d]pyrimidin-5-yl)benzoic acid

Systemtic Name: 4-(2-azanyl-4-oxidanylidene-3H-furo[2,3-d]pyrimidin-5-yl)benzoic acid Openeye Name: 4-(2-amino-4-oxo-3H-furo[2,3-d]pyrimidin-5-yl)benzoic acid CAS Name: 4-(2-amino-4-oxo-3H-furo[2,3-d]pyrimidin-5-yl)benzoic acid IUPAC Name: 4-(2-amino-4-oxo-3H-furo[2,3-d]pyrimidin-5-yl)benzoic acid Traditional Name: 4-(2-amino-4-keto-3H-furo[2,3-d]pyrimidin-5-yl)benzoic acid Formula: C13H9N3O4 MolecularWeight: 271.22826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=COC3=C2C(=O)NC(=N3)N)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=COC3=C2C(=O)NC(=N3)N)C(=O)O

InChI

InChI=1S/C13H9N3O4/c14-13-15-10(17)9-8(5-20-11(9)16-13)6-1-3-7(4-2-6)12(18)19/h1-5H,(H,18,19)(H3,14,15,16,17)