3-phenyl-3-[3-propoxy-6-(pyridin-2-ylamino)-1,2-dihydroindol-3-yl]propanoic acid

Systemtic Name: 3-phenyl-3-[3-propoxy-6-(pyridin-2-ylamino)-1,2-dihydroindol-3-yl]propanoic acid Openeye Name: 3-phenyl-3-[3-propoxy-6-(2-pyridylamino)indolin-3-yl]propanoic acid CAS Name: 3-phenyl-3-[3-propoxy-6-(2-pyridinylamino)-1,2-dihydroindol-3-yl]propanoic acid IUPAC Name: 3-phenyl-3-[3-propoxy-6-(pyridin-2-ylamino)-1,2-dihydroindol-3-yl]propanoic acid Traditional Name: 3-phenyl-3-[3-propoxy-6-(2-pyridylamino)indolin-3-yl]propionic acid Formula: C25H27N3O3 MolecularWeight: 417.50018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1(CNC2=C1C=CC(=C2)NC3=CC=CC=N3)C(CC(=O)O)C4=CC=CC=C4

Isomeric SMILES

CCCOC1(CNC2=C1C=CC(=C2)NC3=CC=CC=N3)C(CC(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O3/c1-2-14-31-25(21(16-24(29)30)18-8-4-3-5-9-18)17-27-22-15-19(11-12-20(22)25)28-23-10-6-7-13-26-23/h3-13,15,21,27H,2,14,16-17H2,1H3,(H,26,28)(H,29,30)