(3S)-1-(5-bromanylpyrimidin-2-yl)piperidine-3-carboxylate

Systemtic Name: (3S)-1-(5-bromanylpyrimidin-2-yl)piperidine-3-carboxylate Openeye Name: (3S)-1-(5-bromopyrimidin-2-yl)piperidine-3-carboxylate CAS Name: (3S)-1-(5-bromo-2-pyrimidinyl)-3-piperidinecarboxylate IUPAC Name: (3S)-1-(5-bromopyrimidin-2-yl)piperidine-3-carboxylate Traditional Name: (3S)-1-(5-bromopyrimidin-2-yl)nipecotate Formula: C10H11BrN3O2- MolecularWeight: 285.11724

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=C(C=N2)Br)C(=O)[O-]

Isomeric SMILES

C1C[C@@H](CN(C1)C2=NC=C(C=N2)Br)C(=O)[O-]

InChI

InChI=1S/C10H12BrN3O2/c11-8-4-12-10(13-5-8)14-3-1-2-7(6-14)9(15)16/h4-5,7H,1-3,6H2,(H,15,16)/p-1/t7-/m0/s1