(E)-5-ethyl-6-methyl-7-nitro-5-oxidanyl-hept-6-en-3-one

Systemtic Name: (E)-5-ethyl-6-methyl-7-nitro-5-oxidanyl-hept-6-en-3-one Openeye Name: (E)-5-ethyl-5-hydroxy-6-methyl-7-nitro-hept-6-en-3-one CAS Name: (E)-5-ethyl-5-hydroxy-6-methyl-7-nitro-6-hepten-3-one IUPAC Name: (E)-5-ethyl-5-hydroxy-6-methyl-7-nitrohept-6-en-3-one Traditional Name: (E)-5-ethyl-5-hydroxy-6-methyl-7-nitro-hept-6-en-3-one Formula: C10H17NO4 MolecularWeight: 215.24628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H17NO4/c1-4-9(12)6-10(13,5-2)8(3)7-11(14)15/h7,13H,4-6H2,1-3H3/b8-7+