tert-butyl 2-[[4-(4-bromanylphenoxy)phenyl]sulfonylamino]-3-methyl-butanoate

Systemtic Name: tert-butyl 2-[[4-(4-bromanylphenoxy)phenyl]sulfonylamino]-3-methyl-butanoate Openeye Name: tert-butyl 2-[[4-(4-bromophenoxy)phenyl]sulfonylamino]-3-methyl-butanoate CAS Name: 2-[[4-(4-bromophenoxy)phenyl]sulfonylamino]-3-methylbutanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[4-(4-bromophenoxy)phenyl]sulfonylamino]-3-methylbutanoate Traditional Name: 2-[[4-(4-bromophenoxy)phenyl]sulfonylamino]-3-methyl-butyric acid tert-butyl ester Formula: C21H26BrNO5S MolecularWeight: 484.40384

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(C)(C)C)NS(=O)(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)Br

Isomeric SMILES

CC(C)C(C(=O)OC(C)(C)C)NS(=O)(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)Br

InChI

InChI=1S/C21H26BrNO5S/c1-14(2)19(20(24)28-21(3,4)5)23-29(25,26)18-12-10-17(11-13-18)27-16-8-6-15(22)7-9-16/h6-14,19,23H,1-5H3