1-[(2R,4S,5S)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-5H-pyrimidin-1-ium-2,4-dione

Systemtic Name: 1-[(2R,4S,5S)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-5H-pyrimidin-1-ium-2,4-dione Openeye Name: 1-[(2R,4S,5S)-4-azido-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5H-pyrimidin-1-ium-2,4-dione CAS Name: 1-[(2R,4S,5S)-4-azido-5-(hydroxymethyl)-2-oxolanyl]-5H-pyrimidin-1-ium-2,4-dione IUPAC Name: 1-[(2R,4S,5S)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-5H-pyrimidin-1-ium-2,4-dione Traditional Name: 1-[(2R,4S,5S)-4-azido-5-methylol-tetrahydrofuran-2-yl]-5H-pyrimidin-1-ium-2,4-quinone Formula: C9H12N5O4+ MolecularWeight: 254.22268

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Descriptors Computed from Structure

Canonical SMILES:

C1C=[N+](C(=O)NC1=O)C2CC(C(O2)CO)N=[N+]=[N-]

Isomeric SMILES

C1C=[N+](C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)N=[N+]=[N-]

InChI

InChI=1S/C9H11N5O4/c10-13-12-5-3-8(18-6(5)4-15)14-2-1-7(16)11-9(14)17/h2,5-6,8,15H,1,3-4H2/p+1/t5-,6+,8+/m0/s1