1-(5-nitro-6-propan-2-yloxy-pyrimidin-4-yl)piperidine-4-carboxylic acid

Systemtic Name: 1-(5-nitro-6-propan-2-yloxy-pyrimidin-4-yl)piperidine-4-carboxylic acid Openeye Name: 1-(6-isopropoxy-5-nitro-pyrimidin-4-yl)piperidine-4-carboxylic acid CAS Name: 1-(5-nitro-6-propan-2-yloxy-4-pyrimidinyl)-4-piperidinecarboxylic acid IUPAC Name: 1-(5-nitro-6-propan-2-yloxypyrimidin-4-yl)piperidine-4-carboxylic acid Traditional Name: 1-(6-isopropoxy-5-nitro-pyrimidin-4-yl)isonipecotic acid Formula: C13H18N4O5 MolecularWeight: 310.30582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NC=NC(=C1[N+](=O)[O-])N2CCC(CC2)C(=O)O

Isomeric SMILES

CC(C)OC1=NC=NC(=C1[N+](=O)[O-])N2CCC(CC2)C(=O)O

InChI

InChI=1S/C13H18N4O5/c1-8(2)22-12-10(17(20)21)11(14-7-15-12)16-5-3-9(4-6-16)13(18)19/h7-9H,3-6H2,1-2H3,(H,18,19)