3-[5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-oxolan-2-yl]isochromene-1,4-dione

Systemtic Name: 3-[5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-oxolan-2-yl]isochromene-1,4-dione Openeye Name: 3-[5-(4-amino-2-oxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]isochromane-1,4-dione CAS Name: 3-[5-(4-amino-2-oxo-1-pyrimidinyl)-3-hydroxy-2-oxolanyl]-3,4-dihydro-1H-2-benzopyran-1,4-dione IUPAC Name: 3-[5-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]isochromene-1,4-dione Traditional Name: 3-[5-(4-amino-2-keto-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]isochroman-1,4-quinone Formula: C17H15N3O6 MolecularWeight: 357.3175

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=CC(=NC2=O)N)C3C(=O)C4=CC=CC=C4C(=O)O3)O

Isomeric SMILES

C1C(C(OC1N2C=CC(=NC2=O)N)C3C(=O)C4=CC=CC=C4C(=O)O3)O

InChI

InChI=1S/C17H15N3O6/c18-11-5-6-20(17(24)19-11)12-7-10(21)14(25-12)15-13(22)8-3-1-2-4-9(8)16(23)26-15/h1-6,10,12,14-15,21H,7H2,(H2,18,19,24)