N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1,1-bis(oxidanylidene)thiolane-3-carboxamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-1,1-bis(oxidanylidene)thiolane-3-carboxamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1,1-dioxo-thiolane-3-carboxamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1,1-dioxo-3-thiolanecarboxamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1,1-dioxothiolane-3-carboxamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-1,1-diketo-thiolane-3-carboxamide Formula: C13H14BrNO5S MolecularWeight: 376.22296

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1C(=O)NC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

C1CS(=O)(=O)CC1C(=O)NC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C13H14BrNO5S/c14-9-5-11-12(20-3-2-19-11)6-10(9)15-13(16)8-1-4-21(17,18)7-8/h5-6,8H,1-4,7H2,(H,15,16)