(3R,4S)-3-(4-tert-butylphenyl)sulfonyl-4-morpholin-4-ium-4-yl-thiolane 1,1-dioxide

Systemtic Name: (3R,4S)-3-(4-tert-butylphenyl)sulfonyl-4-morpholin-4-ium-4-yl-thiolane 1,1-dioxide Openeye Name: (3R,4S)-3-(4-tert-butylphenyl)sulfonyl-4-morpholin-4-ium-4-yl-thiolane 1,1-dioxide CAS Name: (3R,4S)-3-(4-tert-butylphenyl)sulfonyl-4-(4-morpholin-4-iumyl)thiolane 1,1-dioxide IUPAC Name: (3R,4S)-3-(4-tert-butylphenyl)sulfonyl-4-morpholin-4-ium-4-ylthiolane 1,1-dioxide Traditional Name: (3R,4S)-3-(4-tert-butylphenyl)sulfonyl-4-morpholin-4-ium-4-yl-sulfolane Formula: C18H28NO5S2+ MolecularWeight: 402.54862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)C2CS(=O)(=O)CC2[NH+]3CCOCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)[C@H]2CS(=O)(=O)C[C@@H]2[NH+]3CCOCC3

InChI

InChI=1S/C18H27NO5S2/c1-18(2,3)14-4-6-15(7-5-14)26(22,23)17-13-25(20,21)12-16(17)19-8-10-24-11-9-19/h4-7,16-17H,8-13H2,1-3H3/p+1/t16-,17-/m0/s1