3-[4-(2-butoxy-6-ethoxy-phenyl)phenyl]-2-[(2-methyloxolan-2-yl)carbonylamino]propanoic acid

Systemtic Name: 3-[4-(2-butoxy-6-ethoxy-phenyl)phenyl]-2-[(2-methyloxolan-2-yl)carbonylamino]propanoic acid Openeye Name: 3-[4-(2-butoxy-6-ethoxy-phenyl)phenyl]-2-[(2-methyltetrahydrofuran-2-carbonyl)amino]propanoic acid CAS Name: 3-[4-(2-butoxy-6-ethoxyphenyl)phenyl]-2-[[(2-methyl-2-oxolanyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-[4-(2-butoxy-6-ethoxyphenyl)phenyl]-2-[(2-methyloxolane-2-carbonyl)amino]propanoic acid Traditional Name: 3-[4-(2-butoxy-6-ethoxy-phenyl)phenyl]-2-[(2-methyltetrahydrofuran-2-carbonyl)amino]propionic acid Formula: C27H35NO6 MolecularWeight: 469.5699

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1C2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3(CCCO3)C)OCC

Isomeric SMILES

CCCCOC1=CC=CC(=C1C2=CC=C(C=C2)CC(C(=O)O)NC(=O)C3(CCCO3)C)OCC

InChI

InChI=1S/C27H35NO6/c1-4-6-16-33-23-10-7-9-22(32-5-2)24(23)20-13-11-19(12-14-20)18-21(25(29)30)28-26(31)27(3)15-8-17-34-27/h7,9-14,21H,4-6,8,15-18H2,1-3H3,(H,28,31)(H,29,30)