2-(4-chloranyl-3-nitro-phenoxy)-1-[4-[(4-fluorophenyl)methyl]-2-methyl-piperazin-1-yl]ethanone

Systemtic Name: 2-(4-chloranyl-3-nitro-phenoxy)-1-[4-[(4-fluorophenyl)methyl]-2-methyl-piperazin-1-yl]ethanone Openeye Name: 2-(4-chloro-3-nitro-phenoxy)-1-[4-[(4-fluorophenyl)methyl]-2-methyl-piperazin-1-yl]ethanone CAS Name: 2-(4-chloro-3-nitrophenoxy)-1-[4-[(4-fluorophenyl)methyl]-2-methyl-1-piperazinyl]ethanone IUPAC Name: 2-(4-chloro-3-nitrophenoxy)-1-[4-[(4-fluorophenyl)methyl]-2-methylpiperazin-1-yl]ethanone Traditional Name: 2-(4-chloro-3-nitro-phenoxy)-1-[4-(4-fluorobenzyl)-2-methyl-piperazino]ethanone Formula: C20H21ClFN3O4 MolecularWeight: 421.849843

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)COC2=CC(=C(C=C2)Cl)[N+](=O)[O-])CC3=CC=C(C=C3)F

Isomeric SMILES

CC1CN(CCN1C(=O)COC2=CC(=C(C=C2)Cl)[N+](=O)[O-])CC3=CC=C(C=C3)F

InChI

InChI=1S/C20H21ClFN3O4/c1-14-11-23(12-15-2-4-16(22)5-3-15)8-9-24(14)20(26)13-29-17-6-7-18(21)19(10-17)25(27)28/h2-7,10,14H,8-9,11-13H2,1H3