[(3S)-1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]piperidin-3-yl]azanium

Systemtic Name: [(3S)-1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]piperidin-3-yl]azanium Openeye Name: [(3S)-1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-piperidyl]ammonium CAS Name: [(3S)-1-[(1-ethyl-3,5-dimethyl-4-pyrazolyl)methyl]-3-piperidinyl]ammonium IUPAC Name: [(3S)-1-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]piperidin-3-yl]azanium Traditional Name: [(3S)-1-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-3-piperidyl]ammonium Formula: C13H25N4+ MolecularWeight: 237.3644

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)CN2CCCC(C2)[NH3+])C

Isomeric SMILES

CCN1C(=C(C(=N1)C)CN2CCC[C@@H](C2)[NH3+])C

InChI

InChI=1S/C13H24N4/c1-4-17-11(3)13(10(2)15-17)9-16-7-5-6-12(14)8-16/h12H,4-9,14H2,1-3H3/p+1/t12-/m0/s1