ethyl 5-methyl-3-(nitromethyl)heptanoate

Systemtic Name: ethyl 5-methyl-3-(nitromethyl)heptanoate Openeye Name: ethyl 5-methyl-3-(nitromethyl)heptanoate CAS Name: 5-methyl-3-(nitromethyl)heptanoic acid ethyl ester IUPAC Name: ethyl 5-methyl-3-(nitromethyl)heptanoate Traditional Name: 5-methyl-3-(nitromethyl)enanthic acid ethyl ester Formula: C11H21NO4 MolecularWeight: 231.28874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H21NO4/c1-4-9(3)6-10(8-12(14)15)7-11(13)16-5-2/h9-10H,4-8H2,1-3H3