ethyl 3-methyl-3-(nitromethyl)-4-oxidanylidene-hexanoate

Systemtic Name: ethyl 3-methyl-3-(nitromethyl)-4-oxidanylidene-hexanoate Openeye Name: ethyl 3-methyl-3-(nitromethyl)-4-oxo-hexanoate CAS Name: 3-methyl-3-(nitromethyl)-4-oxohexanoic acid ethyl ester IUPAC Name: ethyl 3-methyl-3-(nitromethyl)-4-oxohexanoate Traditional Name: 4-keto-3-methyl-3-(nitromethyl)hexanoic acid ethyl ester Formula: C10H17NO5 MolecularWeight: 231.24568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H17NO5/c1-4-8(12)10(3,7-11(14)15)6-9(13)16-5-2/h4-7H2,1-3H3