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

Systemtic Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (2-fluorophenyl) N-(3-phenoxypropyl)carbamate Openeye Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (2-fluorophenyl) N-(3-phenoxypropyl)carbamate CAS Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; N-(3-phenoxypropyl)carbamic acid (2-fluorophenyl) ester IUPAC Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (2-fluorophenyl) N-(3-phenoxypropyl)carbamate Traditional Name: 2-ethoxy-3-p-phenetyl-propionic acid; N-(3-phenoxypropyl)carbamic acid (2-fluorophenyl) ester Formula: C29H34FNO7 MolecularWeight: 527.581163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC(C(=O)O)OCC.C1=CC=C(C=C1)OCCCNC(=O)OC2=CC=CC=C2F

Isomeric SMILES

CCOC1=CC=C(C=C1)CC(C(=O)O)OCC.C1=CC=C(C=C1)OCCCNC(=O)OC2=CC=CC=C2F

InChI

InChI=1S/C16H16FNO3.C13H18O4/c17-14-9-4-5-10-15(14)21-16(19)18-11-6-12-20-13-7-2-1-3-8-13;1-3-16-11-7-5-10(6-8-11)9-12(13(14)15)17-4-2/h1-5,7-10H,6,11-12H2,(H,18,19);5-8,12H,3-4,9H2,1-2H3,(H,14,15)