(3R,4S)-3-(4-fluoranyl-3-methyl-phenyl)sulfonyl-4-pyrrolidin-1-ium-1-yl-thiolane 1,1-dioxide

Systemtic Name: (3R,4S)-3-(4-fluoranyl-3-methyl-phenyl)sulfonyl-4-pyrrolidin-1-ium-1-yl-thiolane 1,1-dioxide Openeye Name: (3R,4S)-3-(4-fluoro-3-methyl-phenyl)sulfonyl-4-pyrrolidin-1-ium-1-yl-thiolane 1,1-dioxide CAS Name: (3R,4S)-3-(4-fluoro-3-methylphenyl)sulfonyl-4-(1-pyrrolidin-1-iumyl)thiolane 1,1-dioxide IUPAC Name: (3R,4S)-3-(4-fluoro-3-methylphenyl)sulfonyl-4-pyrrolidin-1-ium-1-ylthiolane 1,1-dioxide Traditional Name: (3R,4S)-3-(4-fluoro-3-methyl-phenyl)sulfonyl-4-pyrrolidin-1-ium-1-yl-sulfolane Formula: C15H21FNO4S2+ MolecularWeight: 362.459943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)C2CS(=O)(=O)CC2[NH+]3CCCC3)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)[C@H]2CS(=O)(=O)C[C@@H]2[NH+]3CCCC3)F

InChI

InChI=1S/C15H20FNO4S2/c1-11-8-12(4-5-13(11)16)23(20,21)15-10-22(18,19)9-14(15)17-6-2-3-7-17/h4-5,8,14-15H,2-3,6-7,9-10H2,1H3/p+1/t14-,15-/m0/s1