ethyl 4-[[3,4-bis(fluoranyl)phenyl]methyl-methyl-sulfamoyl]-3-bromanyl-benzoate

Systemtic Name: ethyl 4-[[3,4-bis(fluoranyl)phenyl]methyl-methyl-sulfamoyl]-3-bromanyl-benzoate Openeye Name: ethyl 3-bromo-4-[(3,4-difluorophenyl)methyl-methyl-sulfamoyl]benzoate CAS Name: 3-bromo-4-[(3,4-difluorophenyl)methyl-methylsulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-[(3,4-difluorophenyl)methyl-methylsulfamoyl]benzoate Traditional Name: 3-bromo-4-[(3,4-difluorobenzyl)-methyl-sulfamoyl]benzoic acid ethyl ester Formula: C17H16BrF2NO4S MolecularWeight: 448.279046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)S(=O)(=O)N(C)CC2=CC(=C(C=C2)F)F)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)S(=O)(=O)N(C)CC2=CC(=C(C=C2)F)F)Br

InChI

InChI=1S/C17H16BrF2NO4S/c1-3-25-17(22)12-5-7-16(13(18)9-12)26(23,24)21(2)10-11-4-6-14(19)15(20)8-11/h4-9H,3,10H2,1-2H3