(3S)-1-(5-azanylpyridin-1-ium-2-yl)piperidine-3-carboxylate

Systemtic Name: (3S)-1-(5-azanylpyridin-1-ium-2-yl)piperidine-3-carboxylate Openeye Name: (3S)-1-(5-aminopyridin-1-ium-2-yl)piperidine-3-carboxylate CAS Name: (3S)-1-(5-amino-2-pyridin-1-iumyl)-3-piperidinecarboxylate IUPAC Name: (3S)-1-(5-aminopyridin-1-ium-2-yl)piperidine-3-carboxylate Traditional Name: (3S)-1-(5-aminopyridin-1-ium-2-yl)nipecotate Formula: C11H15N3O2 MolecularWeight: 221.2557

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15N3O2/c12-9-3-4-10(13-6-9)14-5-1-2-8(7-14)11(15)16/h3-4,6,8H,1-2,5,7,12H2,(H,15,16)/t8-/m0/s1