1-(5-nitro-6-pyridin-3-yloxy-pyrimidin-4-yl)piperidine-4-carboxylic acid

Systemtic Name: 1-(5-nitro-6-pyridin-3-yloxy-pyrimidin-4-yl)piperidine-4-carboxylic acid Openeye Name: 1-[5-nitro-6-(3-pyridyloxy)pyrimidin-4-yl]piperidine-4-carboxylic acid CAS Name: 1-[5-nitro-6-(3-pyridinyloxy)-4-pyrimidinyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(5-nitro-6-pyridin-3-yloxypyrimidin-4-yl)piperidine-4-carboxylic acid Traditional Name: 1-[5-nitro-6-(3-pyridyloxy)pyrimidin-4-yl]isonipecotic acid Formula: C15H15N5O5 MolecularWeight: 345.3101

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=C(C(=NC=N2)OC3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=C(C(=NC=N2)OC3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H15N5O5/c21-15(22)10-3-6-19(7-4-10)13-12(20(23)24)14(18-9-17-13)25-11-2-1-5-16-8-11/h1-2,5,8-10H,3-4,6-7H2,(H,21,22)