1-(6-morpholin-4-yl-5-nitro-pyrimidin-4-yl)piperidine-4-carboxylic acid

Systemtic Name: 1-(6-morpholin-4-yl-5-nitro-pyrimidin-4-yl)piperidine-4-carboxylic acid Openeye Name: 1-(6-morpholino-5-nitro-pyrimidin-4-yl)piperidine-4-carboxylic acid CAS Name: 1-[6-(4-morpholinyl)-5-nitro-4-pyrimidinyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(6-morpholin-4-yl-5-nitropyrimidin-4-yl)piperidine-4-carboxylic acid Traditional Name: 1-(6-morpholino-5-nitro-pyrimidin-4-yl)isonipecotic acid Formula: C14H19N5O5 MolecularWeight: 337.33116

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=C(C(=NC=N2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=C(C(=NC=N2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C14H19N5O5/c20-14(21)10-1-3-17(4-2-10)12-11(19(22)23)13(16-9-15-12)18-5-7-24-8-6-18/h9-10H,1-8H2,(H,20,21)