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

Systemtic Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (4-propan-2-ylphenyl) N-(3-methylbutyl)carbamate Openeye Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (4-isopropylphenyl) N-isopentylcarbamate CAS Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; N-(3-methylbutyl)carbamic acid (4-propan-2-ylphenyl) ester IUPAC Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (4-propan-2-ylphenyl) N-(3-methylbutyl)carbamate Traditional Name: 2-ethoxy-3-p-phenetyl-propionic acid; N-isoamylcarbamic acid p-cumenyl ester Formula: C28H41NO6 MolecularWeight: 487.62824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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