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4-methoxy-1-phenyl-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]pyrazole-3-carboxamide
4-methoxy-1-phenyl-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]pyrazole-3-carboxamide
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Descriptors Computed from Structure
Canonical SMILES:
COC1=CN(N=C1C(=O)NCC2(CCCCC2)[NH+]3CCCCC3)C4=CC=CC=C4
Isomeric SMILES
COC1=CN(N=C1C(=O)NCC2(CCCCC2)[NH+]3CCCCC3)C4=CC=CC=C4
InChI
InChI=1S/C23H32N4O2/c1-29-20-17-27(19-11-5-2-6-12-19)25-21(20)22(28)24-18-23(13-7-3-8-14-23)26-15-9-4-10-16-26/h2,5-6,11-12,17H,3-4,7-10,13-16,18H2,1H3,(H,24,28)/p+1
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