dimethyl (2S,3R)-2-hexyl-3-nitro-cyclopropane-1,1-dicarboxylate

Systemtic Name: dimethyl (2S,3R)-2-hexyl-3-nitro-cyclopropane-1,1-dicarboxylate Openeye Name: dimethyl (2S,3R)-2-hexyl-3-nitro-cyclopropane-1,1-dicarboxylate CAS Name: (2S,3R)-2-hexyl-3-nitrocyclopropane-1,1-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2S,3R)-2-hexyl-3-nitrocyclopropane-1,1-dicarboxylate Traditional Name: (2S,3R)-2-hexyl-3-nitro-cyclopropane-1,1-dicarboxylic acid dimethyl ester Formula: C13H21NO6 MolecularWeight: 287.30894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(C1(C(=O)OC)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCCCCC[C@@H]1[C@H](C1(C(=O)OC)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H21NO6/c1-4-5-6-7-8-9-10(14(17)18)13(9,11(15)19-2)12(16)20-3/h9-10H,4-8H2,1-3H3/t9-,10-/m1/s1