[(1S,2S)-2-nitrocyclopropyl]methyl benzoate

Systemtic Name: [(1S,2S)-2-nitrocyclopropyl]methyl benzoate Openeye Name: [(1S,2S)-2-nitrocyclopropyl]methyl benzoate CAS Name: benzoic acid [(1S,2S)-2-nitrocyclopropyl]methyl ester IUPAC Name: [(1S,2S)-2-nitrocyclopropyl]methyl benzoate Traditional Name: benzoic acid [(1S,2S)-2-nitrocyclopropyl]methyl ester Formula: C11H11NO4 MolecularWeight: 221.20934

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C1[N+](=O)[O-])COC(=O)C2=CC=CC=C2

Isomeric SMILES

C1[C@@H]([C@H]1[N+](=O)[O-])COC(=O)C2=CC=CC=C2

InChI

InChI=1S/C11H11NO4/c13-11(8-4-2-1-3-5-8)16-7-9-6-10(9)12(14)15/h1-5,9-10H,6-7H2/t9-,10+/m1/s1