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

Systemtic Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (4-fluorophenyl) N-(2-methylpropyl)carbamate Openeye Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (4-fluorophenyl) N-isobutylcarbamate CAS Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; N-(2-methylpropyl)carbamic acid (4-fluorophenyl) ester IUPAC Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (4-fluorophenyl) N-(2-methylpropyl)carbamate Traditional Name: 2-ethoxy-3-p-phenetyl-propionic acid; N-isobutylcarbamic acid (4-fluorophenyl) ester Formula: C24H32FNO6 MolecularWeight: 449.512383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC(C(=O)O)OCC.CC(C)CNC(=O)OC1=CC=C(C=C1)F

Isomeric SMILES

CCOC1=CC=C(C=C1)CC(C(=O)O)OCC.CC(C)CNC(=O)OC1=CC=C(C=C1)F

InChI

InChI=1S/C13H18O4.C11H14FNO2/c1-3-16-11-7-5-10(6-8-11)9-12(13(14)15)17-4-2;1-8(2)7-13-11(14)15-10-5-3-9(12)4-6-10/h5-8,12H,3-4,9H2,1-2H3,(H,14,15);3-6,8H,7H2,1-2H3,(H,13,14)