N-[(3R,4S)-4-cyanooxolan-3-yl]-4-nitro-benzamide

Systemtic Name: N-[(3R,4S)-4-cyanooxolan-3-yl]-4-nitro-benzamide Openeye Name: N-[(3R,4S)-4-cyanotetrahydrofuran-3-yl]-4-nitro-benzamide CAS Name: N-[(3R,4S)-4-cyano-3-oxolanyl]-4-nitrobenzamide IUPAC Name: N-[(3R,4S)-4-cyanooxolan-3-yl]-4-nitrobenzamide Traditional Name: N-[(3R,4S)-4-cyanotetrahydrofuran-3-yl]-4-nitro-benzamide Formula: C12H11N3O4 MolecularWeight: 261.23344

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CO1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

C1[C@@H]([C@H](CO1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C12H11N3O4/c13-5-9-6-19-7-11(9)14-12(16)8-1-3-10(4-2-8)15(17)18/h1-4,9,11H,6-7H2,(H,14,16)/t9-,11-/m0/s1