1-(3-methylsulfonylphenyl)sulfonylazepane

Systemtic Name: 1-(3-methylsulfonylphenyl)sulfonylazepane Openeye Name: 1-(3-methylsulfonylphenyl)sulfonylazepane CAS Name: 1-(3-methylsulfonylphenyl)sulfonylazepane IUPAC Name: 1-(3-methylsulfonylphenyl)sulfonylazepane Traditional Name: 1-(3-mesylphenyl)sulfonylazepane Formula: C13H19NO4S2 MolecularWeight: 317.42426

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CS(=O)(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C13H19NO4S2/c1-19(15,16)12-7-6-8-13(11-12)20(17,18)14-9-4-2-3-5-10-14/h6-8,11H,2-5,9-10H2,1H3