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

Systemtic Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; 2-methoxyethyl N-pentylcarbamate Openeye Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; 2-methoxyethyl N-pentylcarbamate CAS Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; N-pentylcarbamic acid 2-methoxyethyl ester IUPAC Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; 2-methoxyethyl N-pentylcarbamate Traditional Name: N-amylcarbamic acid 2-methoxyethyl ester; 2-ethoxy-3-p-phenetyl-propionic acid Formula: C22H37NO7 MolecularWeight: 427.53168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O4.C9H19NO3/c1-3-16-11-7-5-10(6-8-11)9-12(13(14)15)17-4-2;1-3-4-5-6-10-9(11)13-8-7-12-2/h5-8,12H,3-4,9H2,1-2H3,(H,14,15);3-8H2,1-2H3,(H,10,11)