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

Systemtic Name: O3-[2-[(1-cyanocyclopentyl)amino]-2-oxidanylidene-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-[(1-cyanocyclopentyl)amino]-2-oxo-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] ester O1-methyl ester IUPAC Name: 3-O-[2-[(1-cyanocyclopentyl)amino]-2-oxoethyl] 1-O-methyl 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-[(1-cyanocyclopentyl)amino]-2-keto-ethyl] ester O1-methyl ester Formula: C17H17N3O7 MolecularWeight: 375.33278

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2(CCCC2)C#N

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2(CCCC2)C#N

InChI

InChI=1S/C17H17N3O7/c1-26-15(22)11-6-12(8-13(7-11)20(24)25)16(23)27-9-14(21)19-17(10-18)4-2-3-5-17/h6-8H,2-5,9H2,1H3,(H,19,21)