O3-[2-(cyclopropylamino)-2-oxidanylidene-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O3-[2-(cyclopropylamino)-2-oxidanylidene-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(cyclopropylamino)-2-oxo-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(cyclopropylamino)-2-oxoethyl] ester O1-methyl ester IUPAC Name: 3-O-[2-(cyclopropylamino)-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(cyclopropylamino)-2-keto-ethyl] ester O1-methyl ester Formula: C14H14N2O7 MolecularWeight: 322.27016

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2CC2

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2CC2

InChI

InChI=1S/C14H14N2O7/c1-22-13(18)8-4-9(6-11(5-8)16(20)21)14(19)23-7-12(17)15-10-2-3-10/h4-6,10H,2-3,7H2,1H3,(H,15,17)