N-(2-chlorophenyl)sulfonylcarbamate; 4-methylbenzenesulfonic acid

Systemtic Name: N-(2-chlorophenyl)sulfonylcarbamate; 4-methylbenzenesulfonic acid Openeye Name: N-(2-chlorophenyl)sulfonylcarbamate; 4-methylbenzenesulfonic acid CAS Name: N-(2-chlorophenyl)sulfonylcarbamate; 4-methylbenzenesulfonic acid IUPAC Name: N-(2-chlorophenyl)sulfonylcarbamate; 4-methylbenzenesulfonic acid Traditional Name: N-(2-chlorophenyl)sulfonylcarbamate; tosylic acid Formula: C14H13ClNO7S2- MolecularWeight: 406.83852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C(=C1)S(=O)(=O)NC(=O)[O-])Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C(=C1)S(=O)(=O)NC(=O)[O-])Cl

InChI

InChI=1S/C7H6ClNO4S.C7H8O3S/c8-5-3-1-2-4-6(5)14(12,13)9-7(10)11;1-6-2-4-7(5-3-6)11(8,9)10/h1-4,9H,(H,10,11);2-5H,1H3,(H,8,9,10)/p-1