2-[[5-[3-(pyridin-2-ylamino)propoxy]-1H-indol-2-yl]methyl]octanoic acid

Systemtic Name: 2-[[5-[3-(pyridin-2-ylamino)propoxy]-1H-indol-2-yl]methyl]octanoic acid Openeye Name: 2-[[5-[3-(2-pyridylamino)propoxy]-1H-indol-2-yl]methyl]octanoic acid CAS Name: 2-[[5-[3-(2-pyridinylamino)propoxy]-1H-indol-2-yl]methyl]octanoic acid IUPAC Name: 2-[[5-[3-(pyridin-2-ylamino)propoxy]-1H-indol-2-yl]methyl]octanoic acid Traditional Name: 2-[[5-[3-(2-pyridylamino)propoxy]-1H-indol-2-yl]methyl]caprylic acid Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC1=CC2=C(N1)C=CC(=C2)OCCCNC3=CC=CC=N3)C(=O)O

Isomeric SMILES

CCCCCCC(CC1=CC2=C(N1)C=CC(=C2)OCCCNC3=CC=CC=N3)C(=O)O

InChI

InChI=1S/C25H33N3O3/c1-2-3-4-5-9-19(25(29)30)16-21-17-20-18-22(11-12-23(20)28-21)31-15-8-14-27-24-10-6-7-13-26-24/h6-7,10-13,17-19,28H,2-5,8-9,14-16H2,1H3,(H,26,27)(H,29,30)