2-isothiocyanatoethanesulfonic acid

Systemtic Name: 2-isothiocyanatoethanesulfonic acid Openeye Name: 2-isothiocyanatoethanesulfonic acid CAS Name: 2-isothiocyanatoethanesulfonic acid IUPAC Name: 2-isothiocyanatoethanesulfonic acid Traditional Name: 2-isothiocyanatoethanesulfonic acid Formula: C3H5NO3S2 MolecularWeight: 167.2067

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Descriptors Computed from Structure

Canonical SMILES:

C(CS(=O)(=O)O)N=C=S

Isomeric SMILES

C(CS(=O)(=O)O)N=C=S

InChI

InChI=1S/C3H5NO3S2/c5-9(6,7)2-1-4-3-8/h1-2H2,(H,5,6,7)