N-[3-[(2S,3R)-2,3-dimethylaziridin-1-yl]-2-oxidanyl-propyl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[3-[(2S,3R)-2,3-dimethylaziridin-1-yl]-2-oxidanyl-propyl]-5-nitro-furan-2-carboxamide Openeye Name: N-[3-[(2S,3R)-2,3-dimethylaziridin-1-yl]-2-hydroxy-propyl]-5-nitro-furan-2-carboxamide CAS Name: N-[3-[(2S,3R)-2,3-dimethyl-1-aziridinyl]-2-hydroxypropyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[3-[(2S,3R)-2,3-dimethylaziridin-1-yl]-2-hydroxypropyl]-5-nitrofuran-2-carboxamide Traditional Name: N-[3-[(2S,3R)-2,3-dimethylethylenimin-1-yl]-2-hydroxy-propyl]-5-nitro-2-furamide Formula: C12H17N3O5 MolecularWeight: 283.28048

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(N1CC(CNC(=O)C2=CC=C(O2)[N+](=O)[O-])O)C

Isomeric SMILES

C[C@@H]1[C@@H](N1CC(CNC(=O)C2=CC=C(O2)[N+](=O)[O-])O)C

InChI

InChI=1S/C12H17N3O5/c1-7-8(2)14(7)6-9(16)5-13-12(17)10-3-4-11(20-10)15(18)19/h3-4,7-9,16H,5-6H2,1-2H3,(H,13,17)/t7-,8+,9?,14?