3-[S-methyl-N-(4-methylphenyl)sulfonyl-sulfinimidoyl]benzoic acid

Systemtic Name: 3-[S-methyl-N-(4-methylphenyl)sulfonyl-sulfinimidoyl]benzoic acid Openeye Name: 3-[S-methyl-N-(p-tolylsulfonyl)sulfinimidoyl]benzoic acid CAS Name: 3-[S-methyl-N-(4-methylphenyl)sulfonylsulfinimidoyl]benzoic acid IUPAC Name: 3-[S-methyl-N-(4-methylphenyl)sulfonylsulfinimidoyl]benzoic acid Traditional Name: 3-(S-methyl-N-tosyl-sulfinimidoyl)benzoic acid Formula: C15H15NO4S2 MolecularWeight: 337.4139

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=S(C)C2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N=[S@@](C)C2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C15H15NO4S2/c1-11-6-8-14(9-7-11)22(19,20)16-21(2)13-5-3-4-12(10-13)15(17)18/h3-10H,1-2H3,(H,17,18)/t21-/m0/s1