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

Systemtic Name: 1-(6-cyclohexyloxy-5-nitro-pyrimidin-4-yl)piperidine-4-carboxylic acid Openeye Name: 1-[6-(cyclohexoxy)-5-nitro-pyrimidin-4-yl]piperidine-4-carboxylic acid CAS Name: 1-(6-cyclohexyloxy-5-nitro-4-pyrimidinyl)-4-piperidinecarboxylic acid IUPAC Name: 1-(6-cyclohexyloxy-5-nitropyrimidin-4-yl)piperidine-4-carboxylic acid Traditional Name: 1-[6-(cyclohexoxy)-5-nitro-pyrimidin-4-yl]isonipecotic acid Formula: C16H22N4O5 MolecularWeight: 350.36968

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC2=NC=NC(=C2[N+](=O)[O-])N3CCC(CC3)C(=O)O

Isomeric SMILES

C1CCC(CC1)OC2=NC=NC(=C2[N+](=O)[O-])N3CCC(CC3)C(=O)O

InChI

InChI=1S/C16H22N4O5/c21-16(22)11-6-8-19(9-7-11)14-13(20(23)24)15(18-10-17-14)25-12-4-2-1-3-5-12/h10-12H,1-9H2,(H,21,22)