diethyl 2-[4-(nitromethyl)-3-oxidanylidene-heptan-4-yl]propanedioate

Systemtic Name: diethyl 2-[4-(nitromethyl)-3-oxidanylidene-heptan-4-yl]propanedioate Openeye Name: diethyl 2-[1-(nitromethyl)-2-oxo-1-propyl-butyl]propanedioate CAS Name: 2-[4-(nitromethyl)-3-oxoheptan-4-yl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[4-(nitromethyl)-3-oxoheptan-4-yl]propanedioate Traditional Name: 2-[2-keto-1-(nitromethyl)-1-propyl-butyl]malonic acid diethyl ester Formula: C15H25NO7 MolecularWeight: 331.3615

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25NO7/c1-5-9-15(10-16(20)21,11(17)6-2)12(13(18)22-7-3)14(19)23-8-4/h12H,5-10H2,1-4H3