ethyl 4-[[[1,1-bis(oxidanylidene)thiolan-3-yl]carbonylamino]sulfamoyl]-3-bromanyl-benzoate

Systemtic Name: ethyl 4-[[[1,1-bis(oxidanylidene)thiolan-3-yl]carbonylamino]sulfamoyl]-3-bromanyl-benzoate Openeye Name: ethyl 3-bromo-4-[[(1,1-dioxothiolane-3-carbonyl)amino]sulfamoyl]benzoate CAS Name: 3-bromo-4-[[[(1,1-dioxo-3-thiolanyl)-oxomethyl]amino]sulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-[[(1,1-dioxothiolane-3-carbonyl)amino]sulfamoyl]benzoate Traditional Name: 3-bromo-4-[[(1,1-diketothiolane-3-carbonyl)amino]sulfamoyl]benzoic acid ethyl ester Formula: C14H17BrN2O7S2 MolecularWeight: 469.32798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)S(=O)(=O)NNC(=O)C2CCS(=O)(=O)C2)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)S(=O)(=O)NNC(=O)C2CCS(=O)(=O)C2)Br

InChI

InChI=1S/C14H17BrN2O7S2/c1-2-24-14(19)9-3-4-12(11(15)7-9)26(22,23)17-16-13(18)10-5-6-25(20,21)8-10/h3-4,7,10,17H,2,5-6,8H2,1H3,(H,16,18)