(5S)-2,7-dimethyl-5-(nitromethyl)-2-oxidanyl-octan-3-one

Systemtic Name: (5S)-2,7-dimethyl-5-(nitromethyl)-2-oxidanyl-octan-3-one Openeye Name: (5S)-2-hydroxy-2,7-dimethyl-5-(nitromethyl)octan-3-one CAS Name: (5S)-2-hydroxy-2,7-dimethyl-5-(nitromethyl)-3-octanone IUPAC Name: (5S)-2-hydroxy-2,7-dimethyl-5-(nitromethyl)octan-3-one Traditional Name: (5S)-2-hydroxy-2,7-dimethyl-5-(nitromethyl)octan-3-one Formula: C11H21NO4 MolecularWeight: 231.28874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)C(C)(C)O)C[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C11H21NO4/c1-8(2)5-9(7-12(15)16)6-10(13)11(3,4)14/h8-9,14H,5-7H2,1-4H3/t9-/m0/s1