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(3S)-N-cyclopropyl-1-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-3-carboxamide
(3S)-N-cyclopropyl-1-[1-[(1-methylpyrazol-4-yl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-3-carboxamide
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Descriptors Computed from Structure
Canonical SMILES:
CN1C=C(C=N1)C[NH+]2CCC(CC2)[NH+]3CCCC(C3)C(=O)NC4CC4
Isomeric SMILES
CN1C=C(C=N1)C[NH+]2CCC(CC2)[NH+]3CCC[C@@H](C3)C(=O)NC4CC4
InChI
InChI=1S/C19H31N5O/c1-22-12-15(11-20-22)13-23-9-6-18(7-10-23)24-8-2-3-16(14-24)19(25)21-17-4-5-17/h11-12,16-18H,2-10,13-14H2,1H3,(H,21,25)/p+2/t16-/m0/s1
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