methyl (1R,2S,3R)-1-cyano-2-nitro-3-phenyl-cyclopropane-1-carboxylate

Systemtic Name: methyl (1R,2S,3R)-1-cyano-2-nitro-3-phenyl-cyclopropane-1-carboxylate Openeye Name: methyl (1R,2S,3R)-1-cyano-2-nitro-3-phenyl-cyclopropanecarboxylate CAS Name: (1R,2S,3R)-1-cyano-2-nitro-3-phenyl-1-cyclopropanecarboxylic acid methyl ester IUPAC Name: methyl (1R,2S,3R)-1-cyano-2-nitro-3-phenylcyclopropane-1-carboxylate Traditional Name: (1R,2S,3R)-1-cyano-2-nitro-3-phenyl-cyclopropanecarboxylic acid methyl ester Formula: C12H10N2O4 MolecularWeight: 246.2188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H10N2O4/c1-18-11(15)12(7-13)9(10(12)14(16)17)8-5-3-2-4-6-8/h2-6,9-10H,1H3/t9-,10-,12+/m0/s1