ethyl 1-(3-ethoxycarbonyl-5-nitro-phenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(3-ethoxycarbonyl-5-nitro-phenyl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(3-ethoxycarbonyl-5-nitro-benzoyl)piperidine-4-carboxylate CAS Name: 1-[(3-ethoxycarbonyl-5-nitrophenyl)-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(3-ethoxycarbonyl-5-nitrobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(3-carbethoxy-5-nitro-benzoyl)isonipecotic acid ethyl ester Formula: C18H22N2O7 MolecularWeight: 378.37648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C18H22N2O7/c1-3-26-17(22)12-5-7-19(8-6-12)16(21)13-9-14(18(23)27-4-2)11-15(10-13)20(24)25/h9-12H,3-8H2,1-2H3