cyanomethyl 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate

Systemtic Name: cyanomethyl 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate Openeye Name: cyanomethyl 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate CAS Name: 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate Traditional Name: 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propionic acid cyanomethyl ester Formula: C12H11F3N2O4S MolecularWeight: 336.28695

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NCCC(=O)OCC#N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NCCC(=O)OCC#N)C(F)(F)F

InChI

InChI=1S/C12H11F3N2O4S/c13-12(14,15)9-2-1-3-10(8-9)22(19,20)17-6-4-11(18)21-7-5-16/h1-3,8,17H,4,6-7H2