[4-(2-methylbutan-2-yl)phenyl] 2-chloranyl-5-[ethyl(phenyl)sulfamoyl]benzoate

Systemtic Name: [4-(2-methylbutan-2-yl)phenyl] 2-chloranyl-5-[ethyl(phenyl)sulfamoyl]benzoate Openeye Name: [4-(1,1-dimethylpropyl)phenyl] 2-chloro-5-[ethyl(phenyl)sulfamoyl]benzoate CAS Name: 2-chloro-5-[ethyl(phenyl)sulfamoyl]benzoic acid [4-(2-methylbutan-2-yl)phenyl] ester IUPAC Name: [4-(2-methylbutan-2-yl)phenyl] 2-chloro-5-[ethyl(phenyl)sulfamoyl]benzoate Traditional Name: 2-chloro-5-[ethyl(phenyl)sulfamoyl]benzoic acid (4-tert-amylphenyl) ester Formula: C26H28ClNO4S MolecularWeight: 486.02282

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OC(=O)C2=C(C=CC(=C2)S(=O)(=O)N(CC)C3=CC=CC=C3)Cl

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OC(=O)C2=C(C=CC(=C2)S(=O)(=O)N(CC)C3=CC=CC=C3)Cl

InChI

InChI=1S/C26H28ClNO4S/c1-5-26(3,4)19-12-14-21(15-13-19)32-25(29)23-18-22(16-17-24(23)27)33(30,31)28(6-2)20-10-8-7-9-11-20/h7-18H,5-6H2,1-4H3