4-[2-methoxy-5-(trifluoromethyl)phenyl]-2-phenyl-1-piperazin-1-yl-butan-1-one

Systemtic Name: 4-[2-methoxy-5-(trifluoromethyl)phenyl]-2-phenyl-1-piperazin-1-yl-butan-1-one Openeye Name: 4-[2-methoxy-5-(trifluoromethyl)phenyl]-2-phenyl-1-piperazin-1-yl-butan-1-one CAS Name: 4-[2-methoxy-5-(trifluoromethyl)phenyl]-2-phenyl-1-(1-piperazinyl)-1-butanone IUPAC Name: 4-[2-methoxy-5-(trifluoromethyl)phenyl]-2-phenyl-1-piperazin-1-ylbutan-1-one Traditional Name: 4-[2-methoxy-5-(trifluoromethyl)phenyl]-2-phenyl-1-piperazino-butan-1-one Formula: C22H25F3N2O2 MolecularWeight: 406.44131

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(F)(F)F)CCC(C2=CC=CC=C2)C(=O)N3CCNCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(F)(F)F)CCC(C2=CC=CC=C2)C(=O)N3CCNCC3

InChI

InChI=1S/C22H25F3N2O2/c1-29-20-10-8-18(22(23,24)25)15-17(20)7-9-19(16-5-3-2-4-6-16)21(28)27-13-11-26-12-14-27/h2-6,8,10,15,19,26H,7,9,11-14H2,1H3