sodium 3-chloranyl-5-methyl-4-nitroso-benzenesulfonate

Systemtic Name: sodium 3-chloranyl-5-methyl-4-nitroso-benzenesulfonate Openeye Name: sodium 3-chloro-5-methyl-4-nitroso-benzenesulfonate CAS Name: sodium 3-chloro-5-methyl-4-nitrosobenzenesulfonate IUPAC Name: sodium 3-chloro-5-methyl-4-nitrosobenzenesulfonate Traditional Name: sodium 3-chloro-5-methyl-4-nitroso-besylate Formula: C7H5ClNNaO4S MolecularWeight: 257.62667

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1N=O)Cl)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC1=CC(=CC(=C1N=O)Cl)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C7H6ClNO4S.Na/c1-4-2-5(14(11,12)13)3-6(8)7(4)9-10;/h2-3H,1H3,(H,11,12,13);/q;+1/p-1