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

Systemtic Name: 1-[4-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]piperazin-1-yl]-3-nitro-phenyl]ethanone Openeye Name: 1-[4-[4-[(2-chloro-6-fluoro-phenyl)methyl]piperazin-1-yl]-3-nitro-phenyl]ethanone CAS Name: 1-[4-[4-[(2-chloro-6-fluorophenyl)methyl]-1-piperazinyl]-3-nitrophenyl]ethanone IUPAC Name: 1-[4-[4-[(2-chloro-6-fluorophenyl)methyl]piperazin-1-yl]-3-nitrophenyl]ethanone Traditional Name: 1-[4-[4-(2-chloro-6-fluoro-benzyl)piperazino]-3-nitro-phenyl]ethanone Formula: C19H19ClFN3O3 MolecularWeight: 391.823863

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC3=C(C=CC=C3Cl)F)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)CC3=C(C=CC=C3Cl)F)[N+](=O)[O-]

InChI

InChI=1S/C19H19ClFN3O3/c1-13(25)14-5-6-18(19(11-14)24(26)27)23-9-7-22(8-10-23)12-15-16(20)3-2-4-17(15)21/h2-6,11H,7-10,12H2,1H3