[1,1-diphosphonoethyl(sulfomethyl)amino]methanesulfonic acid

Systemtic Name: [1,1-diphosphonoethyl(sulfomethyl)amino]methanesulfonic acid Openeye Name: [1,1-diphosphonoethyl(sulfomethyl)amino]methanesulfonic acid CAS Name: [1,1-diphosphonoethyl(sulfomethyl)amino]methanesulfonic acid IUPAC Name: [1,1-diphosphonoethyl(sulfomethyl)amino]methanesulfonic acid Traditional Name: [1,1-diphosphonoethyl(sulfomethyl)amino]methanesulfonic acid Formula: C4H13NO12P2S2 MolecularWeight: 393.223042

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Descriptors Computed from Structure

Canonical SMILES:

CC(N(CS(=O)(=O)O)CS(=O)(=O)O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC(N(CS(=O)(=O)O)CS(=O)(=O)O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C4H13NO12P2S2/c1-4(18(6,7)8,19(9,10)11)5(2-20(12,13)14)3-21(15,16)17/h2-3H2,1H3,(H2,6,7,8)(H2,9,10,11)(H,12,13,14)(H,15,16,17)