(4-tert-butyl-2,6-dimethyl-phenyl)methyl 4-chloranyl-3-sulfamoyl-benzoate

Systemtic Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 4-chloranyl-3-sulfamoyl-benzoate Openeye Name: (4-tert-butyl-2,6-dimethyl-phenyl)methyl 4-chloro-3-sulfamoyl-benzoate CAS Name: 4-chloro-3-sulfamoylbenzoic acid (4-tert-butyl-2,6-dimethylphenyl)methyl ester IUPAC Name: (4-tert-butyl-2,6-dimethylphenyl)methyl 4-chloro-3-sulfamoylbenzoate Traditional Name: 4-chloro-3-sulfamoyl-benzoic acid (4-tert-butyl-2,6-dimethyl-benzyl) ester Formula: C20H24ClNO4S MolecularWeight: 409.92686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N)C)C(C)(C)C

InChI

InChI=1S/C20H24ClNO4S/c1-12-8-15(20(3,4)5)9-13(2)16(12)11-26-19(23)14-6-7-17(21)18(10-14)27(22,24)25/h6-10H,11H2,1-5H3,(H2,22,24,25)