methyl 4-[[[4-(trifluoromethylsulfonyl)phenyl]carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[4-(trifluoromethylsulfonyl)phenyl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[[4-(trifluoromethylsulfonyl)benzoyl]amino]methyl]benzoate CAS Name: 4-[[[oxo-[4-(trifluoromethylsulfonyl)phenyl]methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[4-(trifluoromethylsulfonyl)benzoyl]amino]methyl]benzoate Traditional Name: 4-[[(4-triflylbenzoyl)amino]methyl]benzoic acid methyl ester Formula: C17H14F3NO5S MolecularWeight: 401.35697

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)S(=O)(=O)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)S(=O)(=O)C(F)(F)F

InChI

InChI=1S/C17H14F3NO5S/c1-26-16(23)13-4-2-11(3-5-13)10-21-15(22)12-6-8-14(9-7-12)27(24,25)17(18,19)20/h2-9H,10H2,1H3,(H,21,22)