sodium 3-sulfooxypropyl hydrogen sulfate

Systemtic Name: sodium 3-sulfooxypropyl hydrogen sulfate Openeye Name: sodium 3-sulfooxypropyl hydrogen sulfate CAS Name: sodium sulfuric acid 3-sulfooxypropyl ester IUPAC Name: sodium 3-sulfooxypropyl hydrogen sulfate Traditional Name: sodium sulfuric acid 3-sulfoxypropyl ester Formula: C3H8NaO8S2+ MolecularWeight: 259.21059

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Descriptors Computed from Structure

Canonical SMILES:

C(COS(=O)(=O)O)COS(=O)(=O)O.[Na+]

Isomeric SMILES

C(COS(=O)(=O)O)COS(=O)(=O)O.[Na+]

InChI

InChI=1S/C3H8O8S2.Na/c4-12(5,6)10-2-1-3-11-13(7,8)9;/h1-3H2,(H,4,5,6)(H,7,8,9);/q;+1