[4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]-(2-methyl-4-nitro-pyrazol-3-yl)methanone

Systemtic Name: [4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazin-1-yl]-(2-methyl-4-nitro-pyrazol-3-yl)methanone Openeye Name: [4-[(2-chloro-4-fluoro-phenyl)methyl]piperazin-1-yl]-(2-methyl-4-nitro-pyrazol-3-yl)methanone CAS Name: [4-[(2-chloro-4-fluorophenyl)methyl]-1-piperazinyl]-(2-methyl-4-nitro-3-pyrazolyl)methanone IUPAC Name: [4-[(2-chloro-4-fluorophenyl)methyl]piperazin-1-yl]-(2-methyl-4-nitropyrazol-3-yl)methanone Traditional Name: [4-(2-chloro-4-fluoro-benzyl)piperazino]-(2-methyl-4-nitro-pyrazol-3-yl)methanone Formula: C16H17ClFN5O3 MolecularWeight: 381.789283

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)[N+](=O)[O-])C(=O)N2CCN(CC2)CC3=C(C=C(C=C3)F)Cl

Isomeric SMILES

CN1C(=C(C=N1)[N+](=O)[O-])C(=O)N2CCN(CC2)CC3=C(C=C(C=C3)F)Cl

InChI

InChI=1S/C16H17ClFN5O3/c1-20-15(14(9-19-20)23(25)26)16(24)22-6-4-21(5-7-22)10-11-2-3-12(18)8-13(11)17/h2-3,8-9H,4-7,10H2,1H3