2-[2-oxidanylidene-2-[1-(trifluoromethyl)-4,9-dihydro-3H-pyridazino[3,4-b]indol-2-yl]ethoxy]ethanoic acid

Systemtic Name: 2-[2-oxidanylidene-2-[1-(trifluoromethyl)-4,9-dihydro-3H-pyridazino[3,4-b]indol-2-yl]ethoxy]ethanoic acid Openeye Name: 2-[2-oxo-2-[1-(trifluoromethyl)-4,9-dihydro-3H-pyridazino[3,4-b]indol-2-yl]ethoxy]acetic acid CAS Name: 2-[2-oxo-2-[1-(trifluoromethyl)-4,9-dihydro-3H-pyridazino[3,4-b]indol-2-yl]ethoxy]acetic acid IUPAC Name: 2-[2-oxo-2-[1-(trifluoromethyl)-4,9-dihydro-3H-pyridazino[3,4-b]indol-2-yl]ethoxy]acetic acid Traditional Name: 2-[2-keto-2-[1-(trifluoromethyl)-4,9-dihydro-3H-pyridazin[3,4-b]indol-2-yl]ethoxy]acetic acid Formula: C15H14F3N3O4 MolecularWeight: 357.28457

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N(C2=C1C3=CC=CC=C3N2)C(F)(F)F)C(=O)COCC(=O)O

Isomeric SMILES

C1CN(N(C2=C1C3=CC=CC=C3N2)C(F)(F)F)C(=O)COCC(=O)O

InChI

InChI=1S/C15H14F3N3O4/c16-15(17,18)21-14-10(9-3-1-2-4-11(9)19-14)5-6-20(21)12(22)7-25-8-13(23)24/h1-4,19H,5-8H2,(H,23,24)