(4-nitrophenyl) (2Z)-2-[2,5-bis(oxidanylidene)imidazolidin-4-ylidene]-1-methyl-piperidine-4-carboxylate

Systemtic Name: (4-nitrophenyl) (2Z)-2-[2,5-bis(oxidanylidene)imidazolidin-4-ylidene]-1-methyl-piperidine-4-carboxylate Openeye Name: (4-nitrophenyl) (2Z)-2-(2,5-dioxoimidazolidin-4-ylidene)-1-methyl-piperidine-4-carboxylate CAS Name: (2Z)-2-(2,5-dioxo-4-imidazolidinylidene)-1-methyl-4-piperidinecarboxylic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) (2Z)-2-(2,5-dioxoimidazolidin-4-ylidene)-1-methylpiperidine-4-carboxylate Traditional Name: (2Z)-2-(2,5-diketoimidazolidin-4-ylidene)-1-methyl-isonipecotic acid (4-nitrophenyl) ester Formula: C16H16N4O6 MolecularWeight: 360.32144

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1=C2C(=O)NC(=O)N2)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN\1CCC(C/C1=C/2\C(=O)NC(=O)N2)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N4O6/c1-19-7-6-9(8-12(19)13-14(21)18-16(23)17-13)15(22)26-11-4-2-10(3-5-11)20(24)25/h2-5,9H,6-8H2,1H3,(H2,17,18,21,23)/b13-12-