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

Systemtic Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; ethyl N-(3-propoxypropyl)carbamate Openeye Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; ethyl N-(3-propoxypropyl)carbamate CAS Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; N-(3-propoxypropyl)carbamic acid ethyl ester IUPAC Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; ethyl N-(3-propoxypropyl)carbamate Traditional Name: 2-ethoxy-3-p-phenetyl-propionic acid; N-(3-propoxypropyl)carbamic acid ethyl ester Formula: C22H37NO7 MolecularWeight: 427.53168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCOCCCNC(=O)OCC.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;1-3-7-12-8-5-6-10-9(11)13-4-2/h5-8,12H,3-4,9H2,1-2H3,(H,14,15);3-8H2,1-2H3,(H,10,11)