3-methyl-5-nitro-octan-2-one

Systemtic Name: 3-methyl-5-nitro-octan-2-one Openeye Name: 3-methyl-5-nitro-octan-2-one CAS Name: 3-methyl-5-nitro-2-octanone IUPAC Name: 3-methyl-5-nitrooctan-2-one Traditional Name: 3-methyl-5-nitro-octan-2-one Formula: C9H17NO3 MolecularWeight: 187.23618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H17NO3/c1-4-5-9(10(12)13)6-7(2)8(3)11/h7,9H,4-6H2,1-3H3