5-(3-bromanyl-5-nitro-phenyl)-1-[(2R,4S)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]pyrimidine-2,4-dione

Systemtic Name: 5-(3-bromanyl-5-nitro-phenyl)-1-[(2R,4S)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]pyrimidine-2,4-dione Openeye Name: 5-(3-bromo-5-nitro-phenyl)-1-[(2R,4S)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione CAS Name: 5-(3-bromo-5-nitrophenyl)-1-[(2R,4S)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]pyrimidine-2,4-dione IUPAC Name: 5-(3-bromo-5-nitrophenyl)-1-[(2R,4S)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione Traditional Name: 5-(3-bromo-5-nitro-phenyl)-1-[(2R,4S)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]pyrimidine-2,4-quinone Formula: C15H14BrN3O7 MolecularWeight: 428.19156

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=C(C(=O)NC2=O)C3=CC(=CC(=C3)Br)[N+](=O)[O-])CO)O

Isomeric SMILES

C1[C@@H](C(O[C@H]1N2C=C(C(=O)NC2=O)C3=CC(=CC(=C3)Br)[N+](=O)[O-])CO)O

InChI

InChI=1S/C15H14BrN3O7/c16-8-1-7(2-9(3-8)19(24)25)10-5-18(15(23)17-14(10)22)13-4-11(21)12(6-20)26-13/h1-3,5,11-13,20-21H,4,6H2,(H,17,22,23)/t11-,12?,13+/m0/s1