(3S)-1-(6-nitropyridin-3-yl)piperidine-3-carboxylate

Systemtic Name: (3S)-1-(6-nitropyridin-3-yl)piperidine-3-carboxylate Openeye Name: (3S)-1-(6-nitro-3-pyridyl)piperidine-3-carboxylate CAS Name: (3S)-1-(6-nitro-3-pyridinyl)-3-piperidinecarboxylate IUPAC Name: (3S)-1-(6-nitropyridin-3-yl)piperidine-3-carboxylate Traditional Name: (3S)-1-(6-nitro-3-pyridyl)nipecotate Formula: C11H12N3O4- MolecularWeight: 250.23068

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=CN=C(C=C2)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

C1C[C@@H](CN(C1)C2=CN=C(C=C2)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C11H13N3O4/c15-11(16)8-2-1-5-13(7-8)9-3-4-10(12-6-9)14(17)18/h3-4,6,8H,1-2,5,7H2,(H,15,16)/p-1/t8-/m0/s1