2-[4-[2-(trifluoromethyl)quinolin-4-yl]piperazin-1-yl]carbonylcyclopropane-1-carboxylic acid

Systemtic Name: 2-[4-[2-(trifluoromethyl)quinolin-4-yl]piperazin-1-yl]carbonylcyclopropane-1-carboxylic acid Openeye Name: 2-[4-[2-(trifluoromethyl)-4-quinolyl]piperazine-1-carbonyl]cyclopropanecarboxylic acid CAS Name: 2-[oxo-[4-[2-(trifluoromethyl)-4-quinolinyl]-1-piperazinyl]methyl]-1-cyclopropanecarboxylic acid IUPAC Name: 2-[4-[2-(trifluoromethyl)quinolin-4-yl]piperazine-1-carbonyl]cyclopropane-1-carboxylic acid Traditional Name: 2-[4-[2-(trifluoromethyl)-4-quinolyl]piperazine-1-carbonyl]cyclopropanecarboxylic acid Formula: C19H18F3N3O3 MolecularWeight: 393.35973

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=NC3=CC=CC=C32)C(F)(F)F)C(=O)C4CC4C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC(=NC3=CC=CC=C32)C(F)(F)F)C(=O)C4CC4C(=O)O

InChI

InChI=1S/C19H18F3N3O3/c20-19(21,22)16-10-15(11-3-1-2-4-14(11)23-16)24-5-7-25(8-6-24)17(26)12-9-13(12)18(27)28/h1-4,10,12-13H,5-9H2,(H,27,28)