1H-indol-2-yl-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone

Systemtic Name: 1H-indol-2-yl-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: 1H-indol-2-yl-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: 1H-indol-2-yl-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: 1H-indol-2-yl-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: 1H-indol-2-yl-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]methanone Formula: C20H17F3N4O3 MolecularWeight: 418.36919

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)C3=CC4=CC=CC=C4N3

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)C3=CC4=CC=CC=C4N3

InChI

InChI=1S/C20H17F3N4O3/c21-20(22,23)14-5-6-17(18(12-14)27(29)30)25-7-9-26(10-8-25)19(28)16-11-13-3-1-2-4-15(13)24-16/h1-6,11-12,24H,7-10H2