7-(4-methylsulfonylphenyl)carbonylazepan-2-one

Systemtic Name: 7-(4-methylsulfonylphenyl)carbonylazepan-2-one Openeye Name: 7-(4-methylsulfonylbenzoyl)azepan-2-one CAS Name: 7-[(4-methylsulfonylphenyl)-oxomethyl]-2-azepanone IUPAC Name: 7-(4-methylsulfonylbenzoyl)azepan-2-one Traditional Name: 7-(4-mesylbenzoyl)azepan-2-one Formula: C14H17NO4S MolecularWeight: 295.35408

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)C2CCCCC(=O)N2

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)C2CCCCC(=O)N2

InChI

InChI=1S/C14H17NO4S/c1-20(18,19)11-8-6-10(7-9-11)14(17)12-4-2-3-5-13(16)15-12/h6-9,12H,2-5H2,1H3,(H,15,16)