3-[1-[[(3S)-1-pyrazin-2-ylpiperidin-3-yl]methyl]-1,2,3-triazol-4-yl]propanoate

Systemtic Name: 3-[1-[[(3S)-1-pyrazin-2-ylpiperidin-3-yl]methyl]-1,2,3-triazol-4-yl]propanoate Openeye Name: 3-[1-[[(3S)-1-pyrazin-2-yl-3-piperidyl]methyl]triazol-4-yl]propanoate CAS Name: 3-[1-[[(3S)-1-(2-pyrazinyl)-3-piperidinyl]methyl]-4-triazolyl]propanoate IUPAC Name: 3-[1-[[(3S)-1-pyrazin-2-ylpiperidin-3-yl]methyl]triazol-4-yl]propanoate Traditional Name: 3-[1-[[(3S)-1-pyrazin-2-yl-3-piperidyl]methyl]triazol-4-yl]propionate Formula: C15H19N6O2- MolecularWeight: 315.35036

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CN=C2)CN3C=C(N=N3)CCC(=O)[O-]

Isomeric SMILES

C1C[C@@H](CN(C1)C2=NC=CN=C2)CN3C=C(N=N3)CCC(=O)[O-]

InChI

InChI=1S/C15H20N6O2/c22-15(23)4-3-13-11-21(19-18-13)10-12-2-1-7-20(9-12)14-8-16-5-6-17-14/h5-6,8,11-12H,1-4,7,9-10H2,(H,22,23)/p-1/t12-/m0/s1