propan-2-yl 3-methyl-3-(nitromethyl)-4-oxidanylidene-nonanoate

Systemtic Name: propan-2-yl 3-methyl-3-(nitromethyl)-4-oxidanylidene-nonanoate Openeye Name: isopropyl 3-methyl-3-(nitromethyl)-4-oxo-nonanoate CAS Name: 3-methyl-3-(nitromethyl)-4-oxononanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-methyl-3-(nitromethyl)-4-oxononanoate Traditional Name: 4-keto-3-methyl-3-(nitromethyl)pelargonic acid isopropyl ester Formula: C14H25NO5 MolecularWeight: 287.352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H25NO5/c1-5-6-7-8-12(16)14(4,10-15(18)19)9-13(17)20-11(2)3/h11H,5-10H2,1-4H3