1-[2-tert-butyl-4-[phenyl-[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-2-piperidin-4-yl-ethanone

Systemtic Name: 1-[2-tert-butyl-4-[phenyl-[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-2-piperidin-4-yl-ethanone Openeye Name: 1-[2-tert-butyl-4-[phenyl-[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-2-(4-piperidyl)ethanone CAS Name: 1-[2-tert-butyl-4-[phenyl-[4-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-2-(4-piperidinyl)ethanone IUPAC Name: 1-[2-tert-butyl-4-[phenyl-[4-(trifluoromethyl)phenyl]methyl]piperazin-1-yl]-2-piperidin-4-ylethanone Traditional Name: 1-[2-tert-butyl-4-[phenyl-[4-(trifluoromethyl)phenyl]methyl]piperazino]-2-(4-piperidyl)ethanone Formula: C29H38F3N3O MolecularWeight: 501.62673

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CN(CCN1C(=O)CC2CCNCC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1CN(CCN1C(=O)CC2CCNCC2)C(C3=CC=CC=C3)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C29H38F3N3O/c1-28(2,3)25-20-34(17-18-35(25)26(36)19-21-13-15-33-16-14-21)27(22-7-5-4-6-8-22)23-9-11-24(12-10-23)29(30,31)32/h4-12,21,25,27,33H,13-20H2,1-3H3