methyl 1-(3,5-dinitrophenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-(3,5-dinitrophenyl)carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-(3,5-dinitrobenzoyl)piperidine-4-carboxylate CAS Name: 1-[(3,5-dinitrophenyl)-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(3,5-dinitrobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(3,5-dinitrobenzoyl)isonipecotic acid methyl ester Formula: C14H15N3O7 MolecularWeight: 337.2848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O7/c1-24-14(19)9-2-4-15(5-3-9)13(18)10-6-11(16(20)21)8-12(7-10)17(22)23/h6-9H,2-5H2,1H3