2-methyl-1-nitro-2-prop-2-enoxy-octan-3-one

Systemtic Name: 2-methyl-1-nitro-2-prop-2-enoxy-octan-3-one Openeye Name: 2-allyloxy-2-methyl-1-nitro-octan-3-one CAS Name: 2-methyl-1-nitro-2-prop-2-enoxy-3-octanone IUPAC Name: 2-methyl-1-nitro-2-prop-2-enoxyoctan-3-one Traditional Name: 2-allyloxy-2-methyl-1-nitro-octan-3-one Formula: C12H21NO4 MolecularWeight: 243.29944

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C(C)(C[N+](=O)[O-])OCC=C

Isomeric SMILES

CCCCCC(=O)C(C)(C[N+](=O)[O-])OCC=C

InChI

InChI=1S/C12H21NO4/c1-4-6-7-8-11(14)12(3,10-13(15)16)17-9-5-2/h5H,2,4,6-10H2,1,3H3