methyl (1R,3S)-3-[(1S)-1-nitrobutyl]cyclohexane-1-carboxylate

Systemtic Name: methyl (1R,3S)-3-[(1S)-1-nitrobutyl]cyclohexane-1-carboxylate Openeye Name: methyl (1R,3S)-3-[(1S)-1-nitrobutyl]cyclohexanecarboxylate CAS Name: (1R,3S)-3-[(1S)-1-nitrobutyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1R,3S)-3-[(1S)-1-nitrobutyl]cyclohexane-1-carboxylate Traditional Name: (1R,3S)-3-[(1S)-1-nitrobutyl]cyclohexanecarboxylic acid methyl ester Formula: C12H21NO4 MolecularWeight: 243.29944

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1CCCC(C1)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C12H21NO4/c1-3-5-11(13(15)16)9-6-4-7-10(8-9)12(14)17-2/h9-11H,3-8H2,1-2H3/t9-,10+,11-/m0/s1