propyl 4-[[3,5-bis(trifluoromethyl)phenyl]sulfonylamino]benzoate

Systemtic Name: propyl 4-[[3,5-bis(trifluoromethyl)phenyl]sulfonylamino]benzoate Openeye Name: propyl 4-[[3,5-bis(trifluoromethyl)phenyl]sulfonylamino]benzoate CAS Name: 4-[[3,5-bis(trifluoromethyl)phenyl]sulfonylamino]benzoic acid propyl ester IUPAC Name: propyl 4-[[3,5-bis(trifluoromethyl)phenyl]sulfonylamino]benzoate Traditional Name: 4-[[3,5-bis(trifluoromethyl)phenyl]sulfonylamino]benzoic acid propyl ester Formula: C18H15F6NO4S MolecularWeight: 455.371419

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H15F6NO4S/c1-2-7-29-16(26)11-3-5-14(6-4-11)25-30(27,28)15-9-12(17(19,20)21)8-13(10-15)18(22,23)24/h3-6,8-10,25H,2,7H2,1H3