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(2,4-dimethoxyphenyl)-[(3S)-1-(1H-indol-2-ylmethyl)piperidin-1-ium-3-yl]methanone
(2,4-dimethoxyphenyl)-[(3S)-1-(1H-indol-2-ylmethyl)piperidin-1-ium-3-yl]methanone
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Descriptors Computed from Structure
Canonical SMILES:
COC1=CC(=C(C=C1)C(=O)C2CCC[NH+](C2)CC3=CC4=CC=CC=C4N3)OC
Isomeric SMILES
COC1=CC(=C(C=C1)C(=O)[C@H]2CCC[NH+](C2)CC3=CC4=CC=CC=C4N3)OC
InChI
InChI=1S/C23H26N2O3/c1-27-19-9-10-20(22(13-19)28-2)23(26)17-7-5-11-25(14-17)15-18-12-16-6-3-4-8-21(16)24-18/h3-4,6,8-10,12-13,17,24H,5,7,11,14-15H2,1-2H3/p+1/t17-/m0/s1
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- ethyl 1-[[3-(3-fluoranyl-4-methoxy-phenyl)-1-(2-methylphenyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-carboxylate
- ethyl 1-[[3-(3-fluoranyl-4-methoxy-phenyl)-1-(2-methylphenyl)pyrazol-4-yl]methyl]piperidine-4-carboxylate
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