sodium 2-isocyanatoethanesulfonic acid

Systemtic Name: sodium 2-isocyanatoethanesulfonic acid Openeye Name: sodium 2-isocyanatoethanesulfonic acid CAS Name: sodium 2-isocyanatoethanesulfonic acid IUPAC Name: sodium 2-isocyanatoethanesulfonic acid Traditional Name: sodium 2-isocyanatoethanesulfonic acid Formula: C3H5NNaO4S+ MolecularWeight: 174.13087

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Descriptors Computed from Structure

Canonical SMILES:

C(CS(=O)(=O)O)N=C=O.[Na+]

Isomeric SMILES

C(CS(=O)(=O)O)N=C=O.[Na+]

InChI

InChI=1S/C3H5NO4S.Na/c5-3-4-1-2-9(6,7)8;/h1-2H2,(H,6,7,8);/q;+1