[2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl] (E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-2-[(4-sulfamoylphenyl)methylamino]ethyl] (E)-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enoate Openeye Name: [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] (E)-3-(5-bromo-2-fluoro-phenyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-fluorophenyl)-2-propenoic acid [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] ester IUPAC Name: [2-oxo-2-[(4-sulfamoylphenyl)methylamino]ethyl] (E)-3-(5-bromo-2-fluorophenyl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-fluoro-phenyl)acrylic acid [2-keto-2-[(4-sulfamoylbenzyl)amino]ethyl] ester Formula: C18H16BrFN2O5S MolecularWeight: 471.297443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)COC(=O)C=CC2=C(C=CC(=C2)Br)F)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)COC(=O)/C=C/C2=C(C=CC(=C2)Br)F)S(=O)(=O)N

InChI

InChI=1S/C18H16BrFN2O5S/c19-14-4-7-16(20)13(9-14)3-8-18(24)27-11-17(23)22-10-12-1-5-15(6-2-12)28(21,25)26/h1-9H,10-11H2,(H,22,23)(H2,21,25,26)/b8-3+