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

Systemtic Name: [(3R)-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-ium-3-yl]methylazanium Openeye Name: [(3R)-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-ium-3-yl]methylammonium CAS Name: [(3R)-1-[(1,3,5-trimethyl-4-pyrazolyl)methyl]-3-piperidin-1-iumyl]methylammonium IUPAC Name: [(3R)-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-ium-3-yl]methylazanium Traditional Name: [(3R)-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]piperidin-1-ium-3-yl]methylammonium Formula: C13H26N4+2 MolecularWeight: 238.37234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H24N4/c1-10-13(11(2)16(3)15-10)9-17-6-4-5-12(7-14)8-17/h12H,4-9,14H2,1-3H3/p+2/t12-/m1/s1