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3-(dimethylazaniumyl)propyl-[(3S)-1-(2,4-dimethylphenyl)sulfonylpiperidin-3-yl]-methyl-azanium
3-(dimethylazaniumyl)propyl-[(3S)-1-(2,4-dimethylphenyl)sulfonylpiperidin-3-yl]-methyl-azanium
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC(=C(C=C1)S(=O)(=O)N2CCCC(C2)[NH+](C)CCC[NH+](C)C)C
Isomeric SMILES
CC1=CC(=C(C=C1)S(=O)(=O)N2CCC[C@@H](C2)[NH+](C)CCC[NH+](C)C)C
InChI
InChI=1S/C19H33N3O2S/c1-16-9-10-19(17(2)14-16)25(23,24)22-13-6-8-18(15-22)21(5)12-7-11-20(3)4/h9-10,14,18H,6-8,11-13,15H2,1-5H3/p+2/t18-/m0/s1
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