7-methyl-7-nitro-octan-4-one

Systemtic Name: 7-methyl-7-nitro-octan-4-one Openeye Name: 7-methyl-7-nitro-octan-4-one CAS Name: 7-methyl-7-nitro-4-octanone IUPAC Name: 7-methyl-7-nitrooctan-4-one Traditional Name: 7-methyl-7-nitro-octan-4-one Formula: C9H17NO3 MolecularWeight: 187.23618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H17NO3/c1-4-5-8(11)6-7-9(2,3)10(12)13/h4-7H2,1-3H3