sodium N-chloranyl-4-methyl-benzenesulfonimidate trihydrate

Systemtic Name: sodium N-chloranyl-4-methyl-benzenesulfonimidate trihydrate Openeye Name: sodium N-chloro-4-methyl-benzenesulfonimidate trihydrate CAS Name: sodium N-chloro-4-methylbenzenesulfonimidate trihydrate IUPAC Name: sodium N-chloro-4-methylbenzenesulfonimidate trihydrate Traditional Name: sodium N-chloro-4-methyl-benzenesulfonimidate trihydrate Formula: C7H13ClNNaO5S MolecularWeight: 281.68959

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=NCl)(=O)[O-].O.O.O.[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)S(=NCl)(=O)[O-].O.O.O.[Na+]

InChI

InChI=1S/C7H8ClNO2S.Na.3H2O/c1-6-2-4-7(5-3-6)12(10,11)9-8;;;;/h2-5H,1H3,(H,9,10,11);;3*1H2/q;+1;;;/p-1