diethyl 5-[3-(3-fluoranylphenoxy)propanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: diethyl 5-[3-(3-fluoranylphenoxy)propanoylamino]benzene-1,3-dicarboxylate Openeye Name: diethyl 5-[3-(3-fluorophenoxy)propanoylamino]benzene-1,3-dicarboxylate CAS Name: 5-[[3-(3-fluorophenoxy)-1-oxopropyl]amino]benzene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[3-(3-fluorophenoxy)propanoylamino]benzene-1,3-dicarboxylate Traditional Name: 5-[3-(3-fluorophenoxy)propanoylamino]benzene-1,3-dicarboxylic acid diethyl ester Formula: C21H22FNO6 MolecularWeight: 403.400883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)NC(=O)CCOC2=CC(=CC=C2)F)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)NC(=O)CCOC2=CC(=CC=C2)F)C(=O)OCC

InChI

InChI=1S/C21H22FNO6/c1-3-27-20(25)14-10-15(21(26)28-4-2)12-17(11-14)23-19(24)8-9-29-18-7-5-6-16(22)13-18/h5-7,10-13H,3-4,8-9H2,1-2H3,(H,23,24)