2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (4-propan-2-ylphenyl) N-pentylcarbamate

Systemtic Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (4-propan-2-ylphenyl) N-pentylcarbamate Openeye Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (4-isopropylphenyl) N-pentylcarbamate CAS Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; N-pentylcarbamic acid (4-propan-2-ylphenyl) ester IUPAC Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (4-propan-2-ylphenyl) N-pentylcarbamate Traditional Name: N-amylcarbamic acid p-cumenyl ester; 2-ethoxy-3-p-phenetyl-propionic acid Formula: C28H41NO6 MolecularWeight: 487.62824

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)OC1=CC=C(C=C1)C(C)C.CCOC1=CC=C(C=C1)CC(C(=O)O)OCC

Isomeric SMILES

CCCCCNC(=O)OC1=CC=C(C=C1)C(C)C.CCOC1=CC=C(C=C1)CC(C(=O)O)OCC

InChI

InChI=1S/C15H23NO2.C13H18O4/c1-4-5-6-11-16-15(17)18-14-9-7-13(8-10-14)12(2)3;1-3-16-11-7-5-10(6-8-11)9-12(13(14)15)17-4-2/h7-10,12H,4-6,11H2,1-3H3,(H,16,17);5-8,12H,3-4,9H2,1-2H3,(H,14,15)