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

Systemtic Name: (3-nitro-4-pyrrolidin-1-yl-phenyl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Openeye Name: (3-nitro-4-pyrrolidin-1-yl-phenyl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone CAS Name: [3-nitro-4-(1-pyrrolidinyl)phenyl]-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (3-nitro-4-pyrrolidin-1-ylphenyl)-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methanone Traditional Name: (3-nitro-4-pyrrolidino-phenyl)-[4-[3-(trifluoromethyl)phenyl]piperazino]methanone Formula: C22H23F3N4O3 MolecularWeight: 448.43823

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC(=C4)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C22H23F3N4O3/c23-22(24,25)17-4-3-5-18(15-17)26-10-12-28(13-11-26)21(30)16-6-7-19(20(14-16)29(31)32)27-8-1-2-9-27/h3-7,14-15H,1-2,8-13H2