methyl 1-[(5-nitro-1H-pyrrol-2-yl)carbonyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[(5-nitro-1H-pyrrol-2-yl)carbonyl]piperidine-4-carboxylate Openeye Name: methyl 1-(5-nitro-1H-pyrrole-2-carbonyl)piperidine-4-carboxylate CAS Name: 1-[(5-nitro-1H-pyrrol-2-yl)-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(5-nitro-1H-pyrrole-2-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(5-nitro-1H-pyrrole-2-carbonyl)isonipecotic acid methyl ester Formula: C12H15N3O5 MolecularWeight: 281.2646

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)C2=CC=C(N2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)C2=CC=C(N2)[N+](=O)[O-]

InChI

InChI=1S/C12H15N3O5/c1-20-12(17)8-4-6-14(7-5-8)11(16)9-2-3-10(13-9)15(18)19/h2-3,8,13H,4-7H2,1H3