6-[(1-ethanoylcyclopropyl)amino]-3-fluoranyl-2-pyridin-2-yl-piperazine-1-carboxylic acid

Systemtic Name: 6-[(1-ethanoylcyclopropyl)amino]-3-fluoranyl-2-pyridin-2-yl-piperazine-1-carboxylic acid Openeye Name: 6-[(1-acetylcyclopropyl)amino]-3-fluoro-2-(2-pyridyl)piperazine-1-carboxylic acid CAS Name: 6-[(1-acetylcyclopropyl)amino]-3-fluoro-2-(2-pyridinyl)-1-piperazinecarboxylic acid IUPAC Name: 6-[(1-acetylcyclopropyl)amino]-3-fluoro-2-pyridin-2-ylpiperazine-1-carboxylic acid Traditional Name: 6-[(1-acetylcyclopropyl)amino]-3-fluoro-2-(2-pyridyl)piperazine-1-carboxylic acid Formula: C15H19FN4O3 MolecularWeight: 322.334763

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(CC1)NC2CNC(C(N2C(=O)O)C3=CC=CC=N3)F

Isomeric SMILES

CC(=O)C1(CC1)NC2CNC(C(N2C(=O)O)C3=CC=CC=N3)F

InChI

InChI=1S/C15H19FN4O3/c1-9(21)15(5-6-15)19-11-8-18-13(16)12(20(11)14(22)23)10-4-2-3-7-17-10/h2-4,7,11-13,18-19H,5-6,8H2,1H3,(H,22,23)