1-[3-fluoranyl-4-[4-(2-pyrrolidin-1-ylpyridin-3-yl)carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[3-fluoranyl-4-[4-(2-pyrrolidin-1-ylpyridin-3-yl)carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[3-fluoro-4-[4-(2-pyrrolidin-1-ylpyridine-3-carbonyl)piperazin-1-yl]phenyl]ethanone CAS Name: 1-[3-fluoro-4-[4-[oxo-[2-(1-pyrrolidinyl)-3-pyridinyl]methyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[3-fluoro-4-[4-(2-pyrrolidin-1-ylpyridine-3-carbonyl)piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[3-fluoro-4-[4-(2-pyrrolidinonicotinoyl)piperazino]phenyl]ethanone Formula: C22H25FN4O2 MolecularWeight: 396.457903

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=C(N=CC=C3)N4CCCC4)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=C(N=CC=C3)N4CCCC4)F

InChI

InChI=1S/C22H25FN4O2/c1-16(28)17-6-7-20(19(23)15-17)25-11-13-27(14-12-25)22(29)18-5-4-8-24-21(18)26-9-2-3-10-26/h4-8,15H,2-3,9-14H2,1H3