[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]-(1-methylpyrazol-4-yl)methanone

Systemtic Name: [4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]-(1-methylpyrazol-4-yl)methanone Openeye Name: [4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-1-yl]-(1-methylpyrazol-4-yl)methanone CAS Name: [4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinyl]-(1-methyl-4-pyrazolyl)methanone IUPAC Name: [4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl]-(1-methylpyrazol-4-yl)methanone Traditional Name: [4-(2-chloro-6-fluoro-benzyl)piperazino]-(1-methylpyrazol-4-yl)methanone Formula: C16H18ClFN4O MolecularWeight: 336.791723

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(=O)N2CCN(CC2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CN1C=C(C=N1)C(=O)N2CCN(CC2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C16H18ClFN4O/c1-20-10-12(9-19-20)16(23)22-7-5-21(6-8-22)11-13-14(17)3-2-4-15(13)18/h2-4,9-10H,5-8,11H2,1H3