ethyl 4-[[4-(4-bromanylphenoxy)phenyl]sulfonylamino]benzoate

Systemtic Name: ethyl 4-[[4-(4-bromanylphenoxy)phenyl]sulfonylamino]benzoate Openeye Name: ethyl 4-[[4-(4-bromophenoxy)phenyl]sulfonylamino]benzoate CAS Name: 4-[[4-(4-bromophenoxy)phenyl]sulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[4-(4-bromophenoxy)phenyl]sulfonylamino]benzoate Traditional Name: 4-[[4-(4-bromophenoxy)phenyl]sulfonylamino]benzoic acid ethyl ester Formula: C21H18BrNO5S MolecularWeight: 476.34032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)Br

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H18BrNO5S/c1-2-27-21(24)15-3-7-17(8-4-15)23-29(25,26)20-13-11-19(12-14-20)28-18-9-5-16(22)6-10-18/h3-14,23H,2H2,1H3