(4-tert-butyl-2-methyl-phenyl) 4-morpholin-4-ylsulfonylbenzenesulfonate

Systemtic Name: (4-tert-butyl-2-methyl-phenyl) 4-morpholin-4-ylsulfonylbenzenesulfonate Openeye Name: (4-tert-butyl-2-methyl-phenyl) 4-morpholinosulfonylbenzenesulfonate CAS Name: 4-(4-morpholinylsulfonyl)benzenesulfonic acid (4-tert-butyl-2-methylphenyl) ester IUPAC Name: (4-tert-butyl-2-methylphenyl) 4-morpholin-4-ylsulfonylbenzenesulfonate Traditional Name: 4-morpholinosulfonylbenzenesulfonic acid (4-tert-butyl-2-methyl-phenyl) ester Formula: C21H27NO6S2 MolecularWeight: 453.57218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(C)(C)C)OS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=CC(=C1)C(C)(C)C)OS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H27NO6S2/c1-16-15-17(21(2,3)4)5-10-20(16)28-30(25,26)19-8-6-18(7-9-19)29(23,24)22-11-13-27-14-12-22/h5-10,15H,11-14H2,1-4H3