ethyl 4-(4-chloranyl-3-sulfamoyl-phenyl)sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-(4-chloranyl-3-sulfamoyl-phenyl)sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(4-chloro-3-sulfamoyl-phenyl)sulfonylpiperazine-1-carboxylate CAS Name: 4-(4-chloro-3-sulfamoylphenyl)sulfonyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chloro-3-sulfamoylphenyl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-(4-chloro-3-sulfamoyl-phenyl)sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C13H18ClN3O6S2 MolecularWeight: 411.88152

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N

InChI

InChI=1S/C13H18ClN3O6S2/c1-2-23-13(18)16-5-7-17(8-6-16)25(21,22)10-3-4-11(14)12(9-10)24(15,19)20/h3-4,9H,2,5-8H2,1H3,(H2,15,19,20)