O1-methyl O3-(2-oxidanylidenepropyl) 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-(2-oxidanylidenepropyl) 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-acetonyl O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O1-methyl ester O3-(2-oxopropyl) ester IUPAC Name: 1-O-methyl 3-O-(2-oxopropyl) 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-acetonyl ester O1-methyl ester Formula: C12H11NO7 MolecularWeight: 281.21824

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC(=O)C1=CC(=CC(=C1)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC(=O)COC(=O)C1=CC(=CC(=C1)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C12H11NO7/c1-7(14)6-20-12(16)9-3-8(11(15)19-2)4-10(5-9)13(17)18/h3-5H,6H2,1-2H3