3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(1S)-1-pyridin-2-ylethyl]azanium

Systemtic Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(1S)-1-pyridin-2-ylethyl]azanium Openeye Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(1S)-1-(2-pyridyl)ethyl]ammonium CAS Name: 3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl-[(1S)-1-(2-pyridinyl)ethyl]ammonium IUPAC Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(1S)-1-pyridin-2-ylethyl]azanium Traditional Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(1S)-1-(2-pyridyl)ethyl]ammonium Formula: C16H29N3+2 MolecularWeight: 263.42156

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCC[NH2+]C(C)C2=CC=CC=N2

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCC[NH2+][C@@H](C)C2=CC=CC=N2

InChI

InChI=1S/C16H27N3/c1-14-8-4-6-12-19(14)13-7-11-17-15(2)16-9-3-5-10-18-16/h3,5,9-10,14-15,17H,4,6-8,11-13H2,1-2H3/p+2/t14-,15-/m0/s1