barium; [1,1-bis(oxidanylidene)-3-(sulfomethyl)thietan-3-yl]methanesulfonic acid

Systemtic Name: barium; [1,1-bis(oxidanylidene)-3-(sulfomethyl)thietan-3-yl]methanesulfonic acid Openeye Name: barium; [1,1-dioxo-3-(sulfomethyl)thietan-3-yl]methanesulfonic acid CAS Name: barium; [1,1-dioxo-3-(sulfomethyl)-3-thietanyl]methanesulfonic acid IUPAC Name: barium; [1,1-dioxo-3-(sulfomethyl)thietan-3-yl]methanesulfonic acid Traditional Name: barium; [1,1-diketo-3-(sulfomethyl)thietan-3-yl]methanesulfonic acid Formula: C5H10BaO8S3 MolecularWeight: 431.6501

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CS1(=O)=O)(CS(=O)(=O)O)CS(=O)(=O)O.[Ba]

Isomeric SMILES

C1C(CS1(=O)=O)(CS(=O)(=O)O)CS(=O)(=O)O.[Ba]

InChI

InChI=1S/C5H10O8S3.Ba/c6-14(7)1-5(2-14,3-15(8,9)10)4-16(11,12)13;/h1-4H2,(H,8,9,10)(H,11,12,13);