3-[4-[2-(5-cyanoindol-1-yl)ethoxy]phenyl]-2-phenoxy-propanoic acid

Systemtic Name: 3-[4-[2-(5-cyanoindol-1-yl)ethoxy]phenyl]-2-phenoxy-propanoic acid Openeye Name: 3-[4-[2-(5-cyanoindol-1-yl)ethoxy]phenyl]-2-phenoxy-propanoic acid CAS Name: 3-[4-[2-(5-cyano-1-indolyl)ethoxy]phenyl]-2-phenoxypropanoic acid IUPAC Name: 3-[4-[2-(5-cyanoindol-1-yl)ethoxy]phenyl]-2-phenoxypropanoic acid Traditional Name: 3-[4-[2-(5-cyanoindol-1-yl)ethoxy]phenyl]-2-phenoxy-propionic acid Formula: C26H22N2O4 MolecularWeight: 426.46388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(CC2=CC=C(C=C2)OCCN3C=CC4=C3C=CC(=C4)C#N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)OC(CC2=CC=C(C=C2)OCCN3C=CC4=C3C=CC(=C4)C#N)C(=O)O

InChI

InChI=1S/C26H22N2O4/c27-18-20-8-11-24-21(16-20)12-13-28(24)14-15-31-22-9-6-19(7-10-22)17-25(26(29)30)32-23-4-2-1-3-5-23/h1-13,16,25H,14-15,17H2,(H,29,30)