methyl 3-thiophen-2-yl-3-[[4-(trifluoromethylsulfonyl)phenyl]carbonylamino]propanoate

Systemtic Name: methyl 3-thiophen-2-yl-3-[[4-(trifluoromethylsulfonyl)phenyl]carbonylamino]propanoate Openeye Name: methyl 3-(2-thienyl)-3-[[4-(trifluoromethylsulfonyl)benzoyl]amino]propanoate CAS Name: 3-[[oxo-[4-(trifluoromethylsulfonyl)phenyl]methyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-thiophen-2-yl-3-[[4-(trifluoromethylsulfonyl)benzoyl]amino]propanoate Traditional Name: 3-(2-thienyl)-3-[(4-triflylbenzoyl)amino]propionic acid methyl ester Formula: C16H14F3NO5S2 MolecularWeight: 421.41127

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CS1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)C(F)(F)F

Isomeric SMILES

COC(=O)CC(C1=CC=CS1)NC(=O)C2=CC=C(C=C2)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C16H14F3NO5S2/c1-25-14(21)9-12(13-3-2-8-26-13)20-15(22)10-4-6-11(7-5-10)27(23,24)16(17,18)19/h2-8,12H,9H2,1H3,(H,20,22)