2-[[3-[2-[[(2R)-2-oxidanyl-2-pyridin-3-yl-ethyl]amino]propyl]-1H-indol-7-yl]oxy]butanoic acid; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 2-[[3-[2-[[(2R)-2-oxidanyl-2-pyridin-3-yl-ethyl]amino]propyl]-1H-indol-7-yl]oxy]butanoic acid; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 2-[[3-[2-[[(2R)-2-hydroxy-2-(3-pyridyl)ethyl]amino]propyl]-1H-indol-7-yl]oxy]butanoic acid; 2,2,2-trifluoroacetic acid CAS Name: 2-[[3-[2-[[(2R)-2-hydroxy-2-(3-pyridinyl)ethyl]amino]propyl]-1H-indol-7-yl]oxy]butanoic acid; 2,2,2-trifluoroacetic acid IUPAC Name: 2-[[3-[2-[[(2R)-2-hydroxy-2-pyridin-3-ylethyl]amino]propyl]-1H-indol-7-yl]oxy]butanoic acid; 2,2,2-trifluoroacetic acid Traditional Name: 2-[[3-[2-[[(2R)-2-hydroxy-2-(3-pyridyl)ethyl]amino]propyl]-1H-indol-7-yl]oxy]butyric acid; 2,2,2-trifluoroacetic acid Formula: C26H29F6N3O8 MolecularWeight: 625.514179

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)OC1=CC=CC2=C1NC=C2CC(C)NCC(C3=CN=CC=C3)O.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

Isomeric SMILES

CCC(C(=O)O)OC1=CC=CC2=C1NC=C2CC(C)NC[C@@H](C3=CN=CC=C3)O.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C22H27N3O4.2C2HF3O2/c1-3-19(22(27)28)29-20-8-4-7-17-16(12-25-21(17)20)10-14(2)24-13-18(26)15-6-5-9-23-11-15;2*3-2(4,5)1(6)7/h4-9,11-12,14,18-19,24-26H,3,10,13H2,1-2H3,(H,27,28);2*(H,6,7)/t14?,18-,19?;;/m0../s1