3-[(4-methylsulfonylphenyl)amino]azepan-2-one

Systemtic Name: 3-[(4-methylsulfonylphenyl)amino]azepan-2-one Openeye Name: 3-(4-methylsulfonylanilino)azepan-2-one CAS Name: 3-(4-methylsulfonylanilino)-2-azepanone IUPAC Name: 3-(4-methylsulfonylanilino)azepan-2-one Traditional Name: 3-(4-mesylanilino)azepan-2-one Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC2CCCCNC2=O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NC2CCCCNC2=O

InChI

InChI=1S/C13H18N2O3S/c1-19(17,18)11-7-5-10(6-8-11)15-12-4-2-3-9-14-13(12)16/h5-8,12,15H,2-4,9H2,1H3,(H,14,16)