[4-(furan-2-ylcarbonylamino)phenyl] 2-chloranyl-5-(trifluoromethyl)benzenesulfonate

Systemtic Name: [4-(furan-2-ylcarbonylamino)phenyl] 2-chloranyl-5-(trifluoromethyl)benzenesulfonate Openeye Name: [4-(furan-2-carbonylamino)phenyl] 2-chloro-5-(trifluoromethyl)benzenesulfonate CAS Name: 2-chloro-5-(trifluoromethyl)benzenesulfonic acid [4-[[2-furanyl(oxo)methyl]amino]phenyl] ester IUPAC Name: [4-(furan-2-carbonylamino)phenyl] 2-chloro-5-(trifluoromethyl)benzenesulfonate Traditional Name: 2-chloro-5-(trifluoromethyl)benzenesulfonic acid [4-(2-furoylamino)phenyl] ester Formula: C18H11ClF3NO5S MolecularWeight: 445.79685

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)OS(=O)(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

C1=COC(=C1)C(=O)NC2=CC=C(C=C2)OS(=O)(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C18H11ClF3NO5S/c19-14-8-3-11(18(20,21)22)10-16(14)29(25,26)28-13-6-4-12(5-7-13)23-17(24)15-2-1-9-27-15/h1-10H,(H,23,24)