N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-bromanyl-2-methanoyl-phenoxy)-N-methyl-propanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-2-(4-bromanyl-2-methanoyl-phenoxy)-N-methyl-propanamide Openeye Name: 2-(4-bromo-2-formyl-phenoxy)-N-(1,1-dioxothiolan-3-yl)-N-methyl-propanamide CAS Name: 2-(4-bromo-2-formylphenoxy)-N-(1,1-dioxo-3-thiolanyl)-N-methylpropanamide IUPAC Name: 2-(4-bromo-2-formylphenoxy)-N-(1,1-dioxothiolan-3-yl)-N-methylpropanamide Traditional Name: 2-(4-bromo-2-formyl-phenoxy)-N-(1,1-diketothiolan-3-yl)-N-methyl-propionamide Formula: C15H18BrNO5S MolecularWeight: 404.27612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C1CCS(=O)(=O)C1)OC2=C(C=C(C=C2)Br)C=O

Isomeric SMILES

CC(C(=O)N(C)C1CCS(=O)(=O)C1)OC2=C(C=C(C=C2)Br)C=O

InChI

InChI=1S/C15H18BrNO5S/c1-10(22-14-4-3-12(16)7-11(14)8-18)15(19)17(2)13-5-6-23(20,21)9-13/h3-4,7-8,10,13H,5-6,9H2,1-2H3