3-azanylbenzenesulfonyl fluoride hydrate hydrochloride

Systemtic Name: 3-azanylbenzenesulfonyl fluoride hydrate hydrochloride Openeye Name: 3-aminobenzenesulfonyl fluoride hydrate hydrochloride CAS Name: 3-aminobenzenesulfonyl fluoride hydrate hydrochloride IUPAC Name: 3-aminobenzenesulfonyl fluoride hydrate hydrochloride Traditional Name: 3-aminobenzenesulfonyl fluoride hydrate hydrochloride Formula: C6H9ClFNO3S MolecularWeight: 229.656963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)F)N.O.Cl

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)F)N.O.Cl

InChI

InChI=1S/C6H6FNO2S.ClH.H2O/c7-11(9,10)6-3-1-2-5(8)4-6;;/h1-4H,8H2;1H;1H2