2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (4-phenoxyphenyl) N-(2-propylpentyl)carbamate

Systemtic Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (4-phenoxyphenyl) N-(2-propylpentyl)carbamate Openeye Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (4-phenoxyphenyl) N-(2-propylpentyl)carbamate CAS Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; N-(2-propylpentyl)carbamic acid (4-phenoxyphenyl) ester IUPAC Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (4-phenoxyphenyl) N-(2-propylpentyl)carbamate Traditional Name: 2-ethoxy-3-p-phenetyl-propionic acid; N-(2-propylpentyl)carbamic acid (4-phenoxyphenyl) ester Formula: C34H45NO7 MolecularWeight: 579.7236

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)CNC(=O)OC1=CC=C(C=C1)OC2=CC=CC=C2.CCOC1=CC=C(C=C1)CC(C(=O)O)OCC

Isomeric SMILES

CCCC(CCC)CNC(=O)OC1=CC=C(C=C1)OC2=CC=CC=C2.CCOC1=CC=C(C=C1)CC(C(=O)O)OCC

InChI

InChI=1S/C21H27NO3.C13H18O4/c1-3-8-17(9-4-2)16-22-21(23)25-20-14-12-19(13-15-20)24-18-10-6-5-7-11-18;1-3-16-11-7-5-10(6-8-11)9-12(13(14)15)17-4-2/h5-7,10-15,17H,3-4,8-9,16H2,1-2H3,(H,22,23);5-8,12H,3-4,9H2,1-2H3,(H,14,15)