(3S)-3-[(1S)-1-nitrobutyl]cyclohexan-1-one

Systemtic Name: (3S)-3-[(1S)-1-nitrobutyl]cyclohexan-1-one Openeye Name: (3S)-3-[(1S)-1-nitrobutyl]cyclohexanone CAS Name: (3S)-3-[(1S)-1-nitrobutyl]-1-cyclohexanone IUPAC Name: (3S)-3-[(1S)-1-nitrobutyl]cyclohexan-1-one Traditional Name: (3S)-3-[(1S)-1-nitrobutyl]cyclohexanone Formula: C10H17NO3 MolecularWeight: 199.24688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H17NO3/c1-2-4-10(11(13)14)8-5-3-6-9(12)7-8/h8,10H,2-7H2,1H3/t8-,10-/m0/s1