methyl 4-[[3-(3-fluorophenyl)propanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[3-(3-fluorophenyl)propanoylamino]methyl]benzoate Openeye Name: methyl 4-[[3-(3-fluorophenyl)propanoylamino]methyl]benzoate CAS Name: 4-[[[3-(3-fluorophenyl)-1-oxopropyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(3-fluorophenyl)propanoylamino]methyl]benzoate Traditional Name: 4-[[3-(3-fluorophenyl)propanoylamino]methyl]benzoic acid methyl ester Formula: C18H18FNO3 MolecularWeight: 315.338823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)CCC2=CC(=CC=C2)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)CCC2=CC(=CC=C2)F

InChI

InChI=1S/C18H18FNO3/c1-23-18(22)15-8-5-14(6-9-15)12-20-17(21)10-7-13-3-2-4-16(19)11-13/h2-6,8-9,11H,7,10,12H2,1H3,(H,20,21)