3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(1-methylpyrazol-4-yl)methyl]azanium

Systemtic Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(1-methylpyrazol-4-yl)methyl]azanium Openeye Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(1-methylpyrazol-4-yl)methyl]ammonium CAS Name: 3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl-[(1-methyl-4-pyrazolyl)methyl]ammonium IUPAC Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(1-methylpyrazol-4-yl)methyl]azanium Traditional Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(1-methylpyrazol-4-yl)methyl]ammonium Formula: C14H28N4+2 MolecularWeight: 252.39892

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCC[NH2+]CC2=CN(N=C2)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCC[NH2+]CC2=CN(N=C2)C

InChI

InChI=1S/C14H26N4/c1-13-6-3-4-8-18(13)9-5-7-15-10-14-11-16-17(2)12-14/h11-13,15H,3-10H2,1-2H3/p+2/t13-/m0/s1