2-ethoxy-3-[4-[2-[nonyl(pyridin-2-yl)amino]ethoxy]phenyl]propanoic acid

Systemtic Name: 2-ethoxy-3-[4-[2-[nonyl(pyridin-2-yl)amino]ethoxy]phenyl]propanoic acid Openeye Name: 2-ethoxy-3-[4-[2-[nonyl(2-pyridyl)amino]ethoxy]phenyl]propanoic acid CAS Name: 2-ethoxy-3-[4-[2-[nonyl(2-pyridinyl)amino]ethoxy]phenyl]propanoic acid IUPAC Name: 2-ethoxy-3-[4-[2-[nonyl(pyridin-2-yl)amino]ethoxy]phenyl]propanoic acid Traditional Name: 2-ethoxy-3-[4-[2-[nonyl(2-pyridyl)amino]ethoxy]phenyl]propionic acid Formula: C27H40N2O4 MolecularWeight: 456.6175

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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