1-[4-[4-(2-chloranyl-4-nitro-phenyl)carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]ethanone

Systemtic Name: 1-[4-[4-(2-chloranyl-4-nitro-phenyl)carbonylpiperazin-1-yl]-3-fluoranyl-phenyl]ethanone Openeye Name: 1-[4-[4-(2-chloro-4-nitro-benzoyl)piperazin-1-yl]-3-fluoro-phenyl]ethanone CAS Name: 1-[4-[4-[(2-chloro-4-nitrophenyl)-oxomethyl]-1-piperazinyl]-3-fluorophenyl]ethanone IUPAC Name: 1-[4-[4-(2-chloro-4-nitrobenzoyl)piperazin-1-yl]-3-fluorophenyl]ethanone Traditional Name: 1-[4-[4-(2-chloro-4-nitro-benzoyl)piperazino]-3-fluoro-phenyl]ethanone Formula: C19H17ClFN3O4 MolecularWeight: 405.807383

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl)F

InChI

InChI=1S/C19H17ClFN3O4/c1-12(25)13-2-5-18(17(21)10-13)22-6-8-23(9-7-22)19(26)15-4-3-14(24(27)28)11-16(15)20/h2-5,10-11H,6-9H2,1H3