4-[3-(4-cyano-2-fluoranyl-phenyl)pyrazolo[1,5-a]pyrimidin-7-yl]oxypiperidine-1-carboxylic acid

Systemtic Name: 4-[3-(4-cyano-2-fluoranyl-phenyl)pyrazolo[1,5-a]pyrimidin-7-yl]oxypiperidine-1-carboxylic acid Openeye Name: 4-[3-(4-cyano-2-fluoro-phenyl)pyrazolo[1,5-a]pyrimidin-7-yl]oxypiperidine-1-carboxylic acid CAS Name: 4-[[3-(4-cyano-2-fluorophenyl)-7-pyrazolo[1,5-a]pyrimidinyl]oxy]-1-piperidinecarboxylic acid IUPAC Name: 4-[3-(4-cyano-2-fluorophenyl)pyrazolo[1,5-a]pyrimidin-7-yl]oxypiperidine-1-carboxylic acid Traditional Name: 4-[3-(4-cyano-2-fluoro-phenyl)pyrazolo[1,5-a]pyrimidin-7-yl]oxypiperidine-1-carboxylic acid Formula: C19H16FN5O3 MolecularWeight: 381.360443

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=CC=NC3=C(C=NN23)C4=C(C=C(C=C4)C#N)F)C(=O)O

Isomeric SMILES

C1CN(CCC1OC2=CC=NC3=C(C=NN23)C4=C(C=C(C=C4)C#N)F)C(=O)O

InChI

InChI=1S/C19H16FN5O3/c20-16-9-12(10-21)1-2-14(16)15-11-23-25-17(3-6-22-18(15)25)28-13-4-7-24(8-5-13)19(26)27/h1-3,6,9,11,13H,4-5,7-8H2,(H,26,27)