1-[2-[[2,6-dimethoxy-3-[1-(trifluoromethyl)-1,2,3,4-tetrazol-5-yl]phenyl]methyl]-4-(diphenylmethyl)-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-8-yl]-2-oxidanyl-ethanone

Systemtic Name: 1-[2-[[2,6-dimethoxy-3-[1-(trifluoromethyl)-1,2,3,4-tetrazol-5-yl]phenyl]methyl]-4-(diphenylmethyl)-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-8-yl]-2-oxidanyl-ethanone Openeye Name: 1-[4-benzhydryl-2-[[2,6-dimethoxy-3-[1-(trifluoromethyl)tetrazol-5-yl]phenyl]methyl]-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-8-yl]-2-hydroxy-ethanone CAS Name: 1-[2-[[2,6-dimethoxy-3-[1-(trifluoromethyl)-5-tetrazolyl]phenyl]methyl]-4-(diphenylmethyl)-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-8-yl]-2-hydroxyethanone IUPAC Name: 1-[4-benzhydryl-2-[[2,6-dimethoxy-3-[1-(trifluoromethyl)tetrazol-5-yl]phenyl]methyl]-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-8-yl]-2-hydroxyethanone Traditional Name: 1-[4-benzhydryl-2-[2,6-dimethoxy-3-[1-(trifluoromethyl)tetrazol-5-yl]benzyl]-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-8-yl]-2-hydroxy-ethanone Formula: C33H36F3N7O4 MolecularWeight: 651.67865

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2=NN=NN2C(F)(F)F)OC)CN3CC4CN(CCN4C(C3)C(C5=CC=CC=C5)C6=CC=CC=C6)C(=O)CO

Isomeric SMILES

COC1=C(C(=C(C=C1)C2=NN=NN2C(F)(F)F)OC)CN3CC4CN(CCN4C(C3)C(C5=CC=CC=C5)C6=CC=CC=C6)C(=O)CO

InChI

InChI=1S/C33H36F3N7O4/c1-46-28-14-13-25(32-37-38-39-43(32)33(34,35)36)31(47-2)26(28)19-40-17-24-18-41(29(45)21-44)15-16-42(24)27(20-40)30(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-14,24,27,30,44H,15-21H2,1-2H3