2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; phenethyl N-(2-ethylbutyl)carbamate

Systemtic Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; phenethyl N-(2-ethylbutyl)carbamate Openeye Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; phenethyl N-(2-ethylbutyl)carbamate CAS Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; N-(2-ethylbutyl)carbamic acid phenethyl ester IUPAC Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; phenethyl N-(2-ethylbutyl)carbamate Traditional Name: 2-ethoxy-3-p-phenetyl-propionic acid; N-(2-ethylbutyl)carbamic acid phenethyl ester Formula: C28H41NO6 MolecularWeight: 487.62824

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CNC(=O)OCCC1=CC=CC=C1.CCOC1=CC=C(C=C1)CC(C(=O)O)OCC

Isomeric SMILES

CCC(CC)CNC(=O)OCCC1=CC=CC=C1.CCOC1=CC=C(C=C1)CC(C(=O)O)OCC

InChI

InChI=1S/C15H23NO2.C13H18O4/c1-3-13(4-2)12-16-15(17)18-11-10-14-8-6-5-7-9-14;1-3-16-11-7-5-10(6-8-11)9-12(13(14)15)17-4-2/h5-9,13H,3-4,10-12H2,1-2H3,(H,16,17);5-8,12H,3-4,9H2,1-2H3,(H,14,15)