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(3S)-N-[2-[1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]pyrazol-3-yl]oxolane-3-carboxamide
(3S)-N-[2-[1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-yl]pyrazol-3-yl]oxolane-3-carboxamide
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Descriptors Computed from Structure
Canonical SMILES:
C1C[NH+](CCC1N2C(=CC=N2)NC(=O)C3CCOC3)CCCN4C=CC=N4
Isomeric SMILES
C1COC[C@H]1C(=O)NC2=CC=NN2C3CC[NH+](CC3)CCCN4C=CC=N4
InChI
InChI=1S/C19H28N6O2/c26-19(16-6-14-27-15-16)22-18-3-8-21-25(18)17-4-12-23(13-5-17)9-2-11-24-10-1-7-20-24/h1,3,7-8,10,16-17H,2,4-6,9,11-15H2,(H,22,26)/p+1/t16-/m0/s1
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