3-oxidanylidenebutan-2-yl 4-chloranyl-3-[prop-2-enyl-[3-(trifluoromethyl)phenyl]sulfamoyl]benzoate

Systemtic Name: 3-oxidanylidenebutan-2-yl 4-chloranyl-3-[prop-2-enyl-[3-(trifluoromethyl)phenyl]sulfamoyl]benzoate Openeye Name: (1-methyl-2-oxo-propyl) 3-[allyl-[3-(trifluoromethyl)phenyl]sulfamoyl]-4-chloro-benzoate CAS Name: 4-chloro-3-[prop-2-enyl-[3-(trifluoromethyl)phenyl]sulfamoyl]benzoic acid 3-oxobutan-2-yl ester IUPAC Name: 3-oxobutan-2-yl 4-chloro-3-[prop-2-enyl-[3-(trifluoromethyl)phenyl]sulfamoyl]benzoate Traditional Name: 3-[allyl-[3-(trifluoromethyl)phenyl]sulfamoyl]-4-chloro-benzoic acid (2-keto-1-methyl-propyl) ester Formula: C21H19ClF3NO5S MolecularWeight: 489.89247

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C)OC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N(CC=C)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC(C(=O)C)OC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N(CC=C)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C21H19ClF3NO5S/c1-4-10-26(17-7-5-6-16(12-17)21(23,24)25)32(29,30)19-11-15(8-9-18(19)22)20(28)31-14(3)13(2)27/h4-9,11-12,14H,1,10H2,2-3H3