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

Systemtic Name: 4,4-dimethyl-3-[6-[3-(pyridin-2-ylamino)propoxy]-1H-indol-3-yl]pentanoic acid Openeye Name: 4,4-dimethyl-3-[6-[3-(2-pyridylamino)propoxy]-1H-indol-3-yl]pentanoic acid CAS Name: 4,4-dimethyl-3-[6-[3-(2-pyridinylamino)propoxy]-1H-indol-3-yl]pentanoic acid IUPAC Name: 4,4-dimethyl-3-[6-[3-(pyridin-2-ylamino)propoxy]-1H-indol-3-yl]pentanoic acid Traditional Name: 4,4-dimethyl-3-[6-[3-(2-pyridylamino)propoxy]-1H-indol-3-yl]valeric acid Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CC(=O)O)C1=CNC2=C1C=CC(=C2)OCCCNC3=CC=CC=N3

Isomeric SMILES

CC(C)(C)C(CC(=O)O)C1=CNC2=C1C=CC(=C2)OCCCNC3=CC=CC=N3

InChI

InChI=1S/C23H29N3O3/c1-23(2,3)19(14-22(27)28)18-15-26-20-13-16(8-9-17(18)20)29-12-6-11-25-21-7-4-5-10-24-21/h4-5,7-10,13,15,19,26H,6,11-12,14H2,1-3H3,(H,24,25)(H,27,28)