(4-methylphenyl)methyl 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate

Systemtic Name: (4-methylphenyl)methyl 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate Openeye Name: p-tolylmethyl 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate CAS Name: 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoic acid (4-methylphenyl)methyl ester IUPAC Name: (4-methylphenyl)methyl 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoate Traditional Name: 3-[[3-(trifluoromethyl)phenyl]sulfonylamino]propionic acid (4-methylbenzyl) ester Formula: C18H18F3NO4S MolecularWeight: 401.40003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)COC(=O)CCNS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)COC(=O)CCNS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C18H18F3NO4S/c1-13-5-7-14(8-6-13)12-26-17(23)9-10-22-27(24,25)16-4-2-3-15(11-16)18(19,20)21/h2-8,11,22H,9-10,12H2,1H3