[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]-(2-ethyl-4-nitro-pyrazol-3-yl)methanone

Systemtic Name: [4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]-(2-ethyl-4-nitro-pyrazol-3-yl)methanone Openeye Name: [4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-1-yl]-(2-ethyl-4-nitro-pyrazol-3-yl)methanone CAS Name: [4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinyl]-(2-ethyl-4-nitro-3-pyrazolyl)methanone IUPAC Name: [4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl]-(2-ethyl-4-nitropyrazol-3-yl)methanone Traditional Name: [4-(2-chloro-6-fluoro-benzyl)piperazino]-(2-ethyl-4-nitro-pyrazol-3-yl)methanone Formula: C17H19ClFN5O3 MolecularWeight: 395.815863

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)N2CCN(CC2)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)N2CCN(CC2)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C17H19ClFN5O3/c1-2-23-16(15(10-20-23)24(26)27)17(25)22-8-6-21(7-9-22)11-12-13(18)4-3-5-14(12)19/h3-5,10H,2,6-9,11H2,1H3