2-(4-bromanylphenoxy)-1-(4-methylsulfonyl-1,4-diazepan-1-yl)ethanone

Systemtic Name: 2-(4-bromanylphenoxy)-1-(4-methylsulfonyl-1,4-diazepan-1-yl)ethanone Openeye Name: 2-(4-bromophenoxy)-1-(4-methylsulfonyl-1,4-diazepan-1-yl)ethanone CAS Name: 2-(4-bromophenoxy)-1-(4-methylsulfonyl-1,4-diazepan-1-yl)ethanone IUPAC Name: 2-(4-bromophenoxy)-1-(4-methylsulfonyl-1,4-diazepan-1-yl)ethanone Traditional Name: 2-(4-bromophenoxy)-1-(4-mesyl-1,4-diazepan-1-yl)ethanone Formula: C14H19BrN2O4S MolecularWeight: 391.28066

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCN(CC1)C(=O)COC2=CC=C(C=C2)Br

Isomeric SMILES

CS(=O)(=O)N1CCCN(CC1)C(=O)COC2=CC=C(C=C2)Br

InChI

InChI=1S/C14H19BrN2O4S/c1-22(19,20)17-8-2-7-16(9-10-17)14(18)11-21-13-5-3-12(15)4-6-13/h3-6H,2,7-11H2,1H3