1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-2-thiophen-3-yl-ethanone

Systemtic Name: 1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-2-thiophen-3-yl-ethanone Openeye Name: 1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-2-(3-thienyl)ethanone CAS Name: 1-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]-2-(3-thiophenyl)ethanone IUPAC Name: 1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-2-thiophen-3-ylethanone Traditional Name: 1-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]-2-(3-thienyl)ethanone Formula: C17H16F3N3O3S MolecularWeight: 399.38745

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)CC3=CSC=C3

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)CC3=CSC=C3

InChI

InChI=1S/C17H16F3N3O3S/c18-17(19,20)13-1-2-14(15(10-13)23(25)26)21-4-6-22(7-5-21)16(24)9-12-3-8-27-11-12/h1-3,8,10-11H,4-7,9H2