1,3,5-trimethyl-N-[(3S)-piperidin-1-ium-3-yl]pyrazole-4-carboxamide

Systemtic Name: 1,3,5-trimethyl-N-[(3S)-piperidin-1-ium-3-yl]pyrazole-4-carboxamide Openeye Name: 1,3,5-trimethyl-N-[(3S)-piperidin-1-ium-3-yl]pyrazole-4-carboxamide CAS Name: 1,3,5-trimethyl-N-[(3S)-3-piperidin-1-iumyl]-4-pyrazolecarboxamide IUPAC Name: 1,3,5-trimethyl-N-[(3S)-piperidin-1-ium-3-yl]pyrazole-4-carboxamide Traditional Name: 1,3,5-trimethyl-N-[(3S)-piperidin-1-ium-3-yl]pyrazole-4-carboxamide Formula: C12H21N4O+ MolecularWeight: 237.32134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C(=O)NC2CCC[NH2+]C2

Isomeric SMILES

CC1=C(C(=NN1C)C)C(=O)N[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C12H20N4O/c1-8-11(9(2)16(3)15-8)12(17)14-10-5-4-6-13-7-10/h10,13H,4-7H2,1-3H3,(H,14,17)/p+1/t10-/m0/s1