ethyl 6-[[2-chloranyl-4-[(2-ethoxy-2-oxidanylidene-ethyl)carbamoyl]phenyl]sulfamoyl]cyclohexene-1-carboxylate

Systemtic Name: ethyl 6-[[2-chloranyl-4-[(2-ethoxy-2-oxidanylidene-ethyl)carbamoyl]phenyl]sulfamoyl]cyclohexene-1-carboxylate Openeye Name: ethyl 6-[[2-chloro-4-[(2-ethoxy-2-oxo-ethyl)carbamoyl]phenyl]sulfamoyl]cyclohexene-1-carboxylate CAS Name: 6-[[2-chloro-4-[[(2-ethoxy-2-oxoethyl)amino]-oxomethyl]phenyl]sulfamoyl]-1-cyclohexenecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[[2-chloro-4-[(2-ethoxy-2-oxoethyl)carbamoyl]phenyl]sulfamoyl]cyclohexene-1-carboxylate Traditional Name: 6-[[2-chloro-4-[(2-ethoxy-2-keto-ethyl)carbamoyl]phenyl]sulfamoyl]cyclohexene-1-carboxylic acid ethyl ester Formula: C20H25ClN2O7S MolecularWeight: 472.9397

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=O)C1=CC(=C(C=C1)NS(=O)(=O)C2CCCC=C2C(=O)OCC)Cl

Isomeric SMILES

CCOC(=O)CNC(=O)C1=CC(=C(C=C1)NS(=O)(=O)C2CCCC=C2C(=O)OCC)Cl

InChI

InChI=1S/C20H25ClN2O7S/c1-3-29-18(24)12-22-19(25)13-9-10-16(15(21)11-13)23-31(27,28)17-8-6-5-7-14(17)20(26)30-4-2/h7,9-11,17,23H,3-6,8,12H2,1-2H3,(H,22,25)