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

Systemtic Name: 1-(6-naphthalen-2-yloxy-5-nitro-pyrimidin-4-yl)piperidine-4-carboxylic acid Openeye Name: 1-[6-(2-naphthyloxy)-5-nitro-pyrimidin-4-yl]piperidine-4-carboxylic acid CAS Name: 1-[6-(2-naphthalenyloxy)-5-nitro-4-pyrimidinyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(6-naphthalen-2-yloxy-5-nitropyrimidin-4-yl)piperidine-4-carboxylic acid Traditional Name: 1-[6-(2-naphthoxy)-5-nitro-pyrimidin-4-yl]isonipecotic acid Formula: C20H18N4O5 MolecularWeight: 394.38072

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=C(C(=NC=N2)OC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=C(C(=NC=N2)OC3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O5/c25-20(26)14-7-9-23(10-8-14)18-17(24(27)28)19(22-12-21-18)29-16-6-5-13-3-1-2-4-15(13)11-16/h1-6,11-12,14H,7-10H2,(H,25,26)