[(3R)-1-[(1,5-dimethylpyrazol-4-yl)methyl]piperidin-1-ium-3-yl]methylazanium

Systemtic Name: [(3R)-1-[(1,5-dimethylpyrazol-4-yl)methyl]piperidin-1-ium-3-yl]methylazanium Openeye Name: [(3R)-1-[(1,5-dimethylpyrazol-4-yl)methyl]piperidin-1-ium-3-yl]methylammonium CAS Name: [(3R)-1-[(1,5-dimethyl-4-pyrazolyl)methyl]-3-piperidin-1-iumyl]methylammonium IUPAC Name: [(3R)-1-[(1,5-dimethylpyrazol-4-yl)methyl]piperidin-1-ium-3-yl]methylazanium Traditional Name: [(3R)-1-[(1,5-dimethylpyrazol-4-yl)methyl]piperidin-1-ium-3-yl]methylammonium Formula: C12H24N4+2 MolecularWeight: 224.34576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C[NH+]2CCCC(C2)C[NH3+]

Isomeric SMILES

CC1=C(C=NN1C)C[NH+]2CCC[C@@H](C2)C[NH3+]

InChI

InChI=1S/C12H22N4/c1-10-12(7-14-15(10)2)9-16-5-3-4-11(6-13)8-16/h7,11H,3-6,8-9,13H2,1-2H3/p+2/t11-/m1/s1