1-(1-methyl-5-nitro-pyrrol-2-yl)carbonylpiperidine-4-carboxylate

Systemtic Name: 1-(1-methyl-5-nitro-pyrrol-2-yl)carbonylpiperidine-4-carboxylate Openeye Name: 1-(1-methyl-5-nitro-pyrrole-2-carbonyl)piperidine-4-carboxylate CAS Name: 1-[(1-methyl-5-nitro-2-pyrrolyl)-oxomethyl]-4-piperidinecarboxylate IUPAC Name: 1-(1-methyl-5-nitropyrrole-2-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(1-methyl-5-nitro-pyrrole-2-carbonyl)isonipecotate Formula: C12H14N3O5- MolecularWeight: 280.25666

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1[N+](=O)[O-])C(=O)N2CCC(CC2)C(=O)[O-]

Isomeric SMILES

CN1C(=CC=C1[N+](=O)[O-])C(=O)N2CCC(CC2)C(=O)[O-]

InChI

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