2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (3-methylphenyl) N-(3-phenylpropyl)carbamate

Systemtic Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (3-methylphenyl) N-(3-phenylpropyl)carbamate Openeye Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; m-tolyl N-(3-phenylpropyl)carbamate CAS Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; N-(3-phenylpropyl)carbamic acid (3-methylphenyl) ester IUPAC Name: 2-ethoxy-3-(4-ethoxyphenyl)propanoic acid; (3-methylphenyl) N-(3-phenylpropyl)carbamate Traditional Name: 2-ethoxy-3-p-phenetyl-propionic acid; N-(3-phenylpropyl)carbamic acid m-tolyl ester Formula: C30H37NO6 MolecularWeight: 507.61788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CC(C(=O)O)OCC.CC1=CC(=CC=C1)OC(=O)NCCCC2=CC=CC=C2

Isomeric SMILES

CCOC1=CC=C(C=C1)CC(C(=O)O)OCC.CC1=CC(=CC=C1)OC(=O)NCCCC2=CC=CC=C2

InChI

InChI=1S/C17H19NO2.C13H18O4/c1-14-7-5-11-16(13-14)20-17(19)18-12-6-10-15-8-3-2-4-9-15;1-3-16-11-7-5-10(6-8-11)9-12(13(14)15)17-4-2/h2-5,7-9,11,13H,6,10,12H2,1H3,(H,18,19);5-8,12H,3-4,9H2,1-2H3,(H,14,15)