methyl (2S,4R)-1-(6-chloranyl-5-nitro-pyrimidin-4-yl)-4-oxidanyl-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,4R)-1-(6-chloranyl-5-nitro-pyrimidin-4-yl)-4-oxidanyl-pyrrolidine-2-carboxylate Openeye Name: methyl (2S,4R)-1-(6-chloro-5-nitro-pyrimidin-4-yl)-4-hydroxy-pyrrolidine-2-carboxylate CAS Name: (2S,4R)-1-(6-chloro-5-nitro-4-pyrimidinyl)-4-hydroxy-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,4R)-1-(6-chloro-5-nitropyrimidin-4-yl)-4-hydroxypyrrolidine-2-carboxylate Traditional Name: (2S,4R)-1-(6-chloro-5-nitro-pyrimidin-4-yl)-4-hydroxy-pyrrolidine-2-carboxylic acid methyl ester Formula: C10H11ClN4O5 MolecularWeight: 302.67114

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(CN1C2=C(C(=NC=N2)Cl)[N+](=O)[O-])O

Isomeric SMILES

COC(=O)[C@@H]1C[C@H](CN1C2=C(C(=NC=N2)Cl)[N+](=O)[O-])O

InChI

InChI=1S/C10H11ClN4O5/c1-20-10(17)6-2-5(16)3-14(6)9-7(15(18)19)8(11)12-4-13-9/h4-6,16H,2-3H2,1H3/t5-,6+/m1/s1