ethyl 2-methyl-6-(1-nitro-4-oxidanylidene-pentyl)-2-oxidanyl-oxane-3-carboxylate

Systemtic Name: ethyl 2-methyl-6-(1-nitro-4-oxidanylidene-pentyl)-2-oxidanyl-oxane-3-carboxylate Openeye Name: ethyl 2-hydroxy-2-methyl-6-(1-nitro-4-oxo-pentyl)tetrahydropyran-3-carboxylate CAS Name: 2-hydroxy-2-methyl-6-(1-nitro-4-oxopentyl)-3-oxanecarboxylic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-2-methyl-6-(1-nitro-4-oxopentyl)oxane-3-carboxylate Traditional Name: 2-hydroxy-6-(4-keto-1-nitro-pentyl)-2-methyl-tetrahydropyran-3-carboxylic acid ethyl ester Formula: C14H23NO7 MolecularWeight: 317.33492

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(OC1(C)O)C(CCC(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCC(OC1(C)O)C(CCC(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C14H23NO7/c1-4-21-13(17)10-6-8-12(22-14(10,3)18)11(15(19)20)7-5-9(2)16/h10-12,18H,4-8H2,1-3H3