4-(diphenylmethyl)-2-[[2-fluoranyl-5-[5-(trifluoromethyl)-1,2,3,4-tetrazol-1-yl]phenyl]methyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine dihydrochloride

Systemtic Name: 4-(diphenylmethyl)-2-[[2-fluoranyl-5-[5-(trifluoromethyl)-1,2,3,4-tetrazol-1-yl]phenyl]methyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine dihydrochloride Openeye Name: 4-benzhydryl-2-[[2-fluoro-5-[5-(trifluoromethyl)tetrazol-1-yl]phenyl]methyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine dihydrochloride CAS Name: 4-(diphenylmethyl)-2-[[2-fluoro-5-[5-(trifluoromethyl)-1-tetrazolyl]phenyl]methyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine dihydrochloride IUPAC Name: 4-benzhydryl-2-[[2-fluoro-5-[5-(trifluoromethyl)tetrazol-1-yl]phenyl]methyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine dihydrochloride Traditional Name: 4-benzhydryl-2-[2-fluoro-5-[5-(trifluoromethyl)tetrazol-1-yl]benzyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine dihydrochloride Formula: C29H30Cl2F4N6 MolecularWeight: 609.488313

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CN(CC(N2C1)C(C3=CC=CC=C3)C4=CC=CC=C4)CC5=C(C=CC(=C5)N6C(=NN=N6)C(F)(F)F)F.Cl.Cl

Isomeric SMILES

C1CC2CN(CC(N2C1)C(C3=CC=CC=C3)C4=CC=CC=C4)CC5=C(C=CC(=C5)N6C(=NN=N6)C(F)(F)F)F.Cl.Cl

InChI

InChI=1S/C29H28F4N6.2ClH/c30-25-14-13-23(39-28(29(31,32)33)34-35-36-39)16-22(25)17-37-18-24-12-7-15-38(24)26(19-37)27(20-8-3-1-4-9-20)21-10-5-2-6-11-21;;/h1-6,8-11,13-14,16,24,26-27H,7,12,15,17-19H2;2*1H