methyl 4-[2-[[2-bromanyl-5-(cyclopropylsulfamoyl)phenyl]carbonylamino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[[2-bromanyl-5-(cyclopropylsulfamoyl)phenyl]carbonylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[[2-bromo-5-(cyclopropylsulfamoyl)benzoyl]amino]ethyl]benzoate CAS Name: 4-[2-[[[2-bromo-5-(cyclopropylsulfamoyl)phenyl]-oxomethyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[2-bromo-5-(cyclopropylsulfamoyl)benzoyl]amino]ethyl]benzoate Traditional Name: 4-[2-[[2-bromo-5-(cyclopropylsulfamoyl)benzoyl]amino]ethyl]benzoic acid methyl ester Formula: C20H21BrN2O5S MolecularWeight: 481.36014

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)NC3CC3)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)NC3CC3)Br

InChI

InChI=1S/C20H21BrN2O5S/c1-28-20(25)14-4-2-13(3-5-14)10-11-22-19(24)17-12-16(8-9-18(17)21)29(26,27)23-15-6-7-15/h2-5,8-9,12,15,23H,6-7,10-11H2,1H3,(H,22,24)