(E)-6-methyl-4-nitro-3-oxidanyl-hept-4-en-2-one

Systemtic Name: (E)-6-methyl-4-nitro-3-oxidanyl-hept-4-en-2-one Openeye Name: (E)-3-hydroxy-6-methyl-4-nitro-hept-4-en-2-one CAS Name: (E)-3-hydroxy-6-methyl-4-nitro-4-hepten-2-one IUPAC Name: (E)-3-hydroxy-6-methyl-4-nitrohept-4-en-2-one Traditional Name: (E)-3-hydroxy-6-methyl-4-nitro-hept-4-en-2-one Formula: C8H13NO4 MolecularWeight: 187.19312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H13NO4/c1-5(2)4-7(9(12)13)8(11)6(3)10/h4-5,8,11H,1-3H3/b7-4+