4-methylbenzenesulfonate; N-(4-methylphenyl)sulfonylcarbamate

Systemtic Name: 4-methylbenzenesulfonate; N-(4-methylphenyl)sulfonylcarbamate Openeye Name: 4-methylbenzenesulfonate; N-(p-tolylsulfonyl)carbamate CAS Name: 4-methylbenzenesulfonate; N-(4-methylphenyl)sulfonylcarbamate IUPAC Name: 4-methylbenzenesulfonate; N-(4-methylphenyl)sulfonylcarbamate Traditional Name: N-tosylcarbamate tosylate Formula: C15H15NO7S2-2 MolecularWeight: 385.4121

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H9NO4S.C7H8O3S/c1-6-2-4-7(5-3-6)14(12,13)9-8(10)11;1-6-2-4-7(5-3-6)11(8,9)10/h2-5,9H,1H3,(H,10,11);2-5H,1H3,(H,8,9,10)/p-2