[(2R)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-pyridin-4-yl-ethyl]azanium

Systemtic Name: [(2R)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-pyridin-4-yl-ethyl]azanium Openeye Name: [(2R)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-(4-pyridyl)ethyl]ammonium CAS Name: [(2R)-2-[(3S)-3-methyl-1-piperidin-1-iumyl]-2-pyridin-4-ylethyl]ammonium IUPAC Name: [(2R)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-pyridin-4-ylethyl]azanium Traditional Name: [(2R)-2-[(3S)-3-methylpiperidin-1-ium-1-yl]-2-(4-pyridyl)ethyl]ammonium Formula: C13H23N3+2 MolecularWeight: 221.34182

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C(C[NH3+])C2=CC=NC=C2

Isomeric SMILES

C[C@H]1CCC[NH+](C1)[C@@H](C[NH3+])C2=CC=NC=C2

InChI

InChI=1S/C13H21N3/c1-11-3-2-8-16(10-11)13(9-14)12-4-6-15-7-5-12/h4-7,11,13H,2-3,8-10,14H2,1H3/p+2/t11-,13-/m0/s1