1-[(2S)-1-ethylpyrrolidin-1-ium-2-yl]-N-[(1-methylpyrazol-4-yl)methyl]methanamine

Systemtic Name: 1-[(2S)-1-ethylpyrrolidin-1-ium-2-yl]-N-[(1-methylpyrazol-4-yl)methyl]methanamine Openeye Name: 1-[(2S)-1-ethylpyrrolidin-1-ium-2-yl]-N-[(1-methylpyrazol-4-yl)methyl]methanamine CAS Name: 1-[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]-N-[(1-methyl-4-pyrazolyl)methyl]methanamine IUPAC Name: 1-[(2S)-1-ethylpyrrolidin-1-ium-2-yl]-N-[(1-methylpyrazol-4-yl)methyl]methanamine Traditional Name: [(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl-[(1-methylpyrazol-4-yl)methyl]amine Formula: C12H23N4+ MolecularWeight: 223.33782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNCC2=CN(N=C2)C

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNCC2=CN(N=C2)C

InChI

InChI=1S/C12H22N4/c1-3-16-6-4-5-12(16)9-13-7-11-8-14-15(2)10-11/h8,10,12-13H,3-7,9H2,1-2H3/p+1/t12-/m0/s1