(4-chloranyl-3-nitro-phenyl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone

Systemtic Name: (4-chloranyl-3-nitro-phenyl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: (4-chloro-3-nitro-phenyl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: (4-chloro-3-nitrophenyl)-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (4-chloro-3-nitrophenyl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: (4-chloro-3-nitro-phenyl)-[4-[3-(trifluoromethyl)phenyl]piperazino]methanone Formula: C18H15ClF3N3O3 MolecularWeight: 413.77821

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H15ClF3N3O3/c19-15-5-4-12(10-16(15)25(27)28)17(26)24-8-6-23(7-9-24)14-3-1-2-13(11-14)18(20,21)22/h1-5,10-11H,6-9H2