(2S)-2-nitro-2-(3-oxidanylidenebutyl)cyclooctan-1-one

Systemtic Name: (2S)-2-nitro-2-(3-oxidanylidenebutyl)cyclooctan-1-one Openeye Name: (2S)-2-nitro-2-(3-oxobutyl)cyclooctanone CAS Name: (2S)-2-nitro-2-(3-oxobutyl)-1-cyclooctanone IUPAC Name: (2S)-2-nitro-2-(3-oxobutyl)cyclooctan-1-one Traditional Name: (2S)-2-(3-ketobutyl)-2-nitro-cyclooctanone Formula: C12H19NO4 MolecularWeight: 241.28356

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1(CCCCCCC1=O)[N+](=O)[O-]

Isomeric SMILES

CC(=O)CC[C@]1(CCCCCCC1=O)[N+](=O)[O-]

InChI

InChI=1S/C12H19NO4/c1-10(14)7-9-12(13(16)17)8-5-3-2-4-6-11(12)15/h2-9H2,1H3/t12-/m0/s1