2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (2-fluorophenyl) N-(2-propylpentyl)carbamate

Systemtic Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (2-fluorophenyl) N-(2-propylpentyl)carbamate Openeye Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (2-fluorophenyl) N-(2-propylpentyl)carbamate CAS Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; N-(2-propylpentyl)carbamic acid (2-fluorophenyl) ester IUPAC Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (2-fluorophenyl) N-(2-propylpentyl)carbamate Traditional Name: 2-ethoxy-3-p-phenetyl-propionic acid; N-(2-propylpentyl)carbamic acid (2-fluorophenyl) ester Formula: C28H40FNO6 MolecularWeight: 505.618703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)CNC(=O)OC1=CC=CC=C1F.CCOC1=CC=C(C=C1)CC(C(=O)O)OCC

Isomeric SMILES

CCCC(CCC)CNC(=O)OC1=CC=CC=C1F.CCOC1=CC=C(C=C1)CC(C(=O)O)OCC

InChI

InChI=1S/C15H22FNO2.C13H18O4/c1-3-7-12(8-4-2)11-17-15(18)19-14-10-6-5-9-13(14)16;1-3-16-11-7-5-10(6-8-11)9-12(13(14)15)17-4-2/h5-6,9-10,12H,3-4,7-8,11H2,1-2H3,(H,17,18);5-8,12H,3-4,9H2,1-2H3,(H,14,15)