ethyl 5-ethyl-3-(nitromethyl)heptanoate

Systemtic Name: ethyl 5-ethyl-3-(nitromethyl)heptanoate Openeye Name: ethyl 5-ethyl-3-(nitromethyl)heptanoate CAS Name: 5-ethyl-3-(nitromethyl)heptanoic acid ethyl ester IUPAC Name: ethyl 5-ethyl-3-(nitromethyl)heptanoate Traditional Name: 5-ethyl-3-(nitromethyl)enanthic acid ethyl ester Formula: C12H23NO4 MolecularWeight: 245.31532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H23NO4/c1-4-10(5-2)7-11(9-13(15)16)8-12(14)17-6-3/h10-11H,4-9H2,1-3H3