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

Systemtic Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (4-fluorophenyl) N-(3-propoxypropyl)carbamate Openeye Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (4-fluorophenyl) N-(3-propoxypropyl)carbamate CAS Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; N-(3-propoxypropyl)carbamic acid (4-fluorophenyl) ester IUPAC Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (4-fluorophenyl) N-(3-propoxypropyl)carbamate Traditional Name: 2-ethoxy-3-p-phenetyl-propionic acid; N-(3-propoxypropyl)carbamic acid (4-fluorophenyl) ester Formula: C26H36FNO7 MolecularWeight: 493.564943

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18FNO3.C13H18O4/c1-2-9-17-10-3-8-15-13(16)18-12-6-4-11(14)5-7-12;1-3-16-11-7-5-10(6-8-11)9-12(13(14)15)17-4-2/h4-7H,2-3,8-10H2,1H3,(H,15,16);5-8,12H,3-4,9H2,1-2H3,(H,14,15)