1-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-2-pyrazol-1-yl-ethanone

Systemtic Name: 1-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-2-pyrazol-1-yl-ethanone Openeye Name: 1-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]-2-pyrazol-1-yl-ethanone CAS Name: 1-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]-2-(1-pyrazolyl)ethanone IUPAC Name: 1-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]-2-pyrazol-1-ylethanone Traditional Name: 1-[4-(3-fluoro-4-methoxy-benzyl)piperazino]-2-pyrazol-1-yl-ethanone Formula: C17H21FN4O2 MolecularWeight: 332.372643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)CN3C=CC=N3)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)CN3C=CC=N3)F

InChI

InChI=1S/C17H21FN4O2/c1-24-16-4-3-14(11-15(16)18)12-20-7-9-21(10-8-20)17(23)13-22-6-2-5-19-22/h2-6,11H,7-10,12-13H2,1H3