1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-(3-fluoranyl-4-nitro-phenoxy)ethanone

Systemtic Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-(3-fluoranyl-4-nitro-phenoxy)ethanone Openeye Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-(3-fluoro-4-nitro-phenoxy)ethanone CAS Name: 1-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-2-(3-fluoro-4-nitrophenoxy)ethanone IUPAC Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-(3-fluoro-4-nitrophenoxy)ethanone Traditional Name: 1-[4-(4-chlorobenzyl)piperazino]-2-(3-fluoro-4-nitro-phenoxy)ethanone Formula: C19H19ClFN3O4 MolecularWeight: 407.823263

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)Cl)C(=O)COC3=CC(=C(C=C3)[N+](=O)[O-])F

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)Cl)C(=O)COC3=CC(=C(C=C3)[N+](=O)[O-])F

InChI

InChI=1S/C19H19ClFN3O4/c20-15-3-1-14(2-4-15)12-22-7-9-23(10-8-22)19(25)13-28-16-5-6-18(24(26)27)17(21)11-16/h1-6,11H,7-10,12-13H2