3-pyridin-4-yl-3-[6-[3-(pyridin-2-ylamino)propoxy]-1H-indol-3-yl]propanoic acid

Systemtic Name: 3-pyridin-4-yl-3-[6-[3-(pyridin-2-ylamino)propoxy]-1H-indol-3-yl]propanoic acid Openeye Name: 3-(4-pyridyl)-3-[6-[3-(2-pyridylamino)propoxy]-1H-indol-3-yl]propanoic acid CAS Name: 3-pyridin-4-yl-3-[6-[3-(2-pyridinylamino)propoxy]-1H-indol-3-yl]propanoic acid IUPAC Name: 3-pyridin-4-yl-3-[6-[3-(pyridin-2-ylamino)propoxy]-1H-indol-3-yl]propanoic acid Traditional Name: 3-(4-pyridyl)-3-[6-[3-(2-pyridylamino)propoxy]-1H-indol-3-yl]propionic acid Formula: C24H24N4O3 MolecularWeight: 416.47236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NCCCOC2=CC3=C(C=C2)C(=CN3)C(CC(=O)O)C4=CC=NC=C4

Isomeric SMILES

C1=CC=NC(=C1)NCCCOC2=CC3=C(C=C2)C(=CN3)C(CC(=O)O)C4=CC=NC=C4

InChI

InChI=1S/C24H24N4O3/c29-24(30)15-20(17-7-11-25-12-8-17)21-16-28-22-14-18(5-6-19(21)22)31-13-3-10-27-23-4-1-2-9-26-23/h1-2,4-9,11-12,14,16,20,28H,3,10,13,15H2,(H,26,27)(H,29,30)