ethyl 2-benzamido-3,3,3-tris(fluoranyl)-2-[(4-sulfamoylphenyl)amino]propanoate

Systemtic Name: ethyl 2-benzamido-3,3,3-tris(fluoranyl)-2-[(4-sulfamoylphenyl)amino]propanoate Openeye Name: ethyl 2-benzamido-3,3,3-trifluoro-2-(4-sulfamoylanilino)propanoate CAS Name: 2-benzamido-3,3,3-trifluoro-2-(4-sulfamoylanilino)propanoic acid ethyl ester IUPAC Name: ethyl 2-benzamido-3,3,3-trifluoro-2-(4-sulfamoylanilino)propanoate Traditional Name: 2-benzamido-3,3,3-trifluoro-2-(4-sulfamoylanilino)propionic acid ethyl ester Formula: C18H18F3N3O5S MolecularWeight: 445.41283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(F)(F)F)(NC1=CC=C(C=C1)S(=O)(=O)N)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(C(F)(F)F)(NC1=CC=C(C=C1)S(=O)(=O)N)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H18F3N3O5S/c1-2-29-16(26)17(18(19,20)21,24-15(25)12-6-4-3-5-7-12)23-13-8-10-14(11-9-13)30(22,27)28/h3-11,23H,2H2,1H3,(H,24,25)(H2,22,27,28)