3-[1-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-1,2,3-triazol-4-yl]propanoate

Systemtic Name: 3-[1-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]-1,2,3-triazol-4-yl]propanoate Openeye Name: 3-[1-[1-(4,6-dimethylpyrimidin-2-yl)-4-piperidyl]triazol-4-yl]propanoate CAS Name: 3-[1-[1-(4,6-dimethyl-2-pyrimidinyl)-4-piperidinyl]-4-triazolyl]propanoate IUPAC Name: 3-[1-[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]triazol-4-yl]propanoate Traditional Name: 3-[1-[1-(4,6-dimethylpyrimidin-2-yl)-4-piperidyl]triazol-4-yl]propionate Formula: C16H21N6O2- MolecularWeight: 329.37694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCC(CC2)N3C=C(N=N3)CCC(=O)[O-])C

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCC(CC2)N3C=C(N=N3)CCC(=O)[O-])C

InChI

InChI=1S/C16H22N6O2/c1-11-9-12(2)18-16(17-11)21-7-5-14(6-8-21)22-10-13(19-20-22)3-4-15(23)24/h9-10,14H,3-8H2,1-2H3,(H,23,24)/p-1