1-[3,3-dimethyl-6-(6-quinolin-7-yloxypyrimidin-4-yl)-2H-indol-1-yl]ethanone; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 1-[3,3-dimethyl-6-(6-quinolin-7-yloxypyrimidin-4-yl)-2H-indol-1-yl]ethanone; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 1-[3,3-dimethyl-6-[6-(7-quinolyloxy)pyrimidin-4-yl]indolin-1-yl]ethanone; 2,2,2-trifluoroacetic acid CAS Name: 1-[3,3-dimethyl-6-[6-(7-quinolinyloxy)-4-pyrimidinyl]-2H-indol-1-yl]ethanone; 2,2,2-trifluoroacetic acid IUPAC Name: 1-[3,3-dimethyl-6-(6-quinolin-7-yloxypyrimidin-4-yl)-2H-indol-1-yl]ethanone; 2,2,2-trifluoroacetic acid Traditional Name: 1-[3,3-dimethyl-6-[6-(7-quinolyloxy)pyrimidin-4-yl]indolin-1-yl]ethanone; 2,2,2-trifluoroacetic acid Formula: C27H23F3N4O4 MolecularWeight: 524.49113

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(C2=C1C=C(C=C2)C3=CC(=NC=N3)OC4=CC5=C(C=CC=N5)C=C4)(C)C.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC(=O)N1CC(C2=C1C=C(C=C2)C3=CC(=NC=N3)OC4=CC5=C(C=CC=N5)C=C4)(C)C.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C25H22N4O2.C2HF3O2/c1-16(30)29-14-25(2,3)20-9-7-18(11-23(20)29)22-13-24(28-15-27-22)31-19-8-6-17-5-4-10-26-21(17)12-19;3-2(4,5)1(6)7/h4-13,15H,14H2,1-3H3;(H,6,7)