barium; [4-(sulfomethyl)phenyl]methanesulfonic acid

Systemtic Name: barium; [4-(sulfomethyl)phenyl]methanesulfonic acid Openeye Name: barium; [4-(sulfomethyl)phenyl]methanesulfonic acid CAS Name: barium; [4-(sulfomethyl)phenyl]methanesulfonic acid IUPAC Name: barium; [4-(sulfomethyl)phenyl]methanesulfonic acid Traditional Name: barium; [4-(sulfomethyl)phenyl]methanesulfonic acid Formula: C8H10BaO6S2 MolecularWeight: 403.6184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CS(=O)(=O)O)CS(=O)(=O)O.[Ba]

Isomeric SMILES

C1=CC(=CC=C1CS(=O)(=O)O)CS(=O)(=O)O.[Ba]

InChI

InChI=1S/C8H10O6S2.Ba/c9-15(10,11)5-7-1-2-8(4-3-7)6-16(12,13)14;/h1-4H,5-6H2,(H,9,10,11)(H,12,13,14);