2-ethoxy-3-[3-[2-[nonyl(pyridin-2-yl)amino]ethoxy]phenyl]propanoic acid

Systemtic Name: 2-ethoxy-3-[3-[2-[nonyl(pyridin-2-yl)amino]ethoxy]phenyl]propanoic acid Openeye Name: 2-ethoxy-3-[3-[2-[nonyl(2-pyridyl)amino]ethoxy]phenyl]propanoic acid CAS Name: 2-ethoxy-3-[3-[2-[nonyl(2-pyridinyl)amino]ethoxy]phenyl]propanoic acid IUPAC Name: 2-ethoxy-3-[3-[2-[nonyl(pyridin-2-yl)amino]ethoxy]phenyl]propanoic acid Traditional Name: 2-ethoxy-3-[3-[2-[nonyl(2-pyridyl)amino]ethoxy]phenyl]propionic acid Formula: C27H40N2O4 MolecularWeight: 456.6175

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCN(CCOC1=CC=CC(=C1)CC(C(=O)O)OCC)C2=CC=CC=N2

Isomeric SMILES

CCCCCCCCCN(CCOC1=CC=CC(=C1)CC(C(=O)O)OCC)C2=CC=CC=N2

InChI

InChI=1S/C27H40N2O4/c1-3-5-6-7-8-9-12-18-29(26-16-10-11-17-28-26)19-20-33-24-15-13-14-23(21-24)22-25(27(30)31)32-4-2/h10-11,13-17,21,25H,3-9,12,18-20,22H2,1-2H3,(H,30,31)