methyl 3-(hydroxymethyl)-5-[[3-(trifluoromethyl)phenyl]methylcarbamoyl]benzoate

Systemtic Name: methyl 3-(hydroxymethyl)-5-[[3-(trifluoromethyl)phenyl]methylcarbamoyl]benzoate Openeye Name: methyl 3-(hydroxymethyl)-5-[[3-(trifluoromethyl)phenyl]methylcarbamoyl]benzoate CAS Name: 3-(hydroxymethyl)-5-[oxo-[[3-(trifluoromethyl)phenyl]methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-(hydroxymethyl)-5-[[3-(trifluoromethyl)phenyl]methylcarbamoyl]benzoate Traditional Name: 3-methylol-5-[[3-(trifluoromethyl)benzyl]carbamoyl]benzoic acid methyl ester Formula: C18H16F3NO4 MolecularWeight: 367.31915

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)NCC2=CC(=CC=C2)C(F)(F)F)CO

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)NCC2=CC(=CC=C2)C(F)(F)F)CO

InChI

InChI=1S/C18H16F3NO4/c1-26-17(25)14-6-12(10-23)5-13(8-14)16(24)22-9-11-3-2-4-15(7-11)18(19,20)21/h2-8,23H,9-10H2,1H3,(H,22,24)