ethyl 1-(2-methyl-3,5-dinitro-phenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(2-methyl-3,5-dinitro-phenyl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(2-methyl-3,5-dinitro-benzoyl)piperidine-4-carboxylate CAS Name: 1-[(2-methyl-3,5-dinitrophenyl)-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-methyl-3,5-dinitrobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(2-methyl-3,5-dinitro-benzoyl)isonipecotic acid ethyl ester Formula: C16H19N3O7 MolecularWeight: 365.33796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=CC(=C2C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=CC(=C2C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O7/c1-3-26-16(21)11-4-6-17(7-5-11)15(20)13-8-12(18(22)23)9-14(10(13)2)19(24)25/h8-9,11H,3-7H2,1-2H3