ethyl 4-[3-(2-oxidanylidene-6-sulfamoyl-1,3-benzoxazol-3-yl)propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(2-oxidanylidene-6-sulfamoyl-1,3-benzoxazol-3-yl)propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(2-oxo-6-sulfamoyl-1,3-benzoxazol-3-yl)propanoyl]piperazine-1-carboxylate CAS Name: 4-[1-oxo-3-(2-oxo-6-sulfamoyl-1,3-benzoxazol-3-yl)propyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(2-oxo-6-sulfamoyl-1,3-benzoxazol-3-yl)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(2-keto-6-sulfamoyl-1,3-benzoxazol-3-yl)propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H22N4O7S MolecularWeight: 426.44418

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CCN2C3=C(C=C(C=C3)S(=O)(=O)N)OC2=O

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CCN2C3=C(C=C(C=C3)S(=O)(=O)N)OC2=O

InChI

InChI=1S/C17H22N4O7S/c1-2-27-16(23)20-9-7-19(8-10-20)15(22)5-6-21-13-4-3-12(29(18,25)26)11-14(13)28-17(21)24/h3-4,11H,2,5-10H2,1H3,(H2,18,25,26)