3-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine

Systemtic Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine Openeye Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine CAS Name: 3-[(2S)-2-methyl-1-piperidin-1-iumyl]-N-[(1,3,5-trimethyl-4-pyrazolyl)methyl]-1-propanamine IUPAC Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-1-amine Traditional Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(1,3,5-trimethylpyrazol-4-yl)methyl]amine Formula: C16H31N4+ MolecularWeight: 279.44414

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNCC2=C(N(N=C2C)C)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNCC2=C(N(N=C2C)C)C

InChI

InChI=1S/C16H30N4/c1-13-8-5-6-10-20(13)11-7-9-17-12-16-14(2)18-19(4)15(16)3/h13,17H,5-12H2,1-4H3/p+1/t13-/m0/s1