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

Systemtic Name: methyl 3-(nitromethyl)-4-oxidanylidene-3-propyl-hexanoate Openeye Name: methyl 3-(nitromethyl)-4-oxo-3-propyl-hexanoate CAS Name: 3-(nitromethyl)-4-oxo-3-propylhexanoic acid methyl ester IUPAC Name: methyl 3-(nitromethyl)-4-oxo-3-propylhexanoate Traditional Name: 4-keto-3-(nitromethyl)-3-propyl-hexanoic acid methyl ester Formula: C11H19NO5 MolecularWeight: 245.27226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H19NO5/c1-4-6-11(8-12(15)16,9(13)5-2)7-10(14)17-3/h4-8H2,1-3H3