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(3S)-3-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-ium-1-yl]oxolan-2-one
(3S)-3-[4-(2,3,5,6-tetramethylphenyl)sulfonylpiperazin-1-ium-1-yl]oxolan-2-one
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC(=C(C(=C1C)S(=O)(=O)N2CC[NH+](CC2)C3CCOC3=O)C)C
Isomeric SMILES
CC1=CC(=C(C(=C1C)S(=O)(=O)N2CC[NH+](CC2)[C@H]3CCOC3=O)C)C
InChI
InChI=1S/C18H26N2O4S/c1-12-11-13(2)15(4)17(14(12)3)25(22,23)20-8-6-19(7-9-20)16-5-10-24-18(16)21/h11,16H,5-10H2,1-4H3/p+1/t16-/m0/s1
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