N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(3-bromanylphenoxy)-N-methyl-ethanamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-(3-bromanylphenoxy)-N-methyl-ethanamide Openeye Name: 2-(3-bromophenoxy)-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methyl-acetamide CAS Name: 2-(3-bromophenoxy)-N-[(3S)-1,1-dioxo-3-thiolanyl]-N-methylacetamide IUPAC Name: 2-(3-bromophenoxy)-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methylacetamide Traditional Name: 2-(3-bromophenoxy)-N-[(3S)-1,1-diketothiolan-3-yl]-N-methyl-acetamide Formula: C13H16BrNO4S MolecularWeight: 362.23944

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C(=O)COC2=CC(=CC=C2)Br

Isomeric SMILES

CN([C@H]1CCS(=O)(=O)C1)C(=O)COC2=CC(=CC=C2)Br

InChI

InChI=1S/C13H16BrNO4S/c1-15(11-5-6-20(17,18)9-11)13(16)8-19-12-4-2-3-10(14)7-12/h2-4,7,11H,5-6,8-9H2,1H3/t11-/m0/s1