6-(diphenylmethyl)-4-[[2-methoxy-5-[5-(trifluoromethyl)-1,2,3,4-tetrazol-1-yl]phenyl]methyl]-3,3-dimethyl-piperazin-2-one hydrochloride

Systemtic Name: 6-(diphenylmethyl)-4-[[2-methoxy-5-[5-(trifluoromethyl)-1,2,3,4-tetrazol-1-yl]phenyl]methyl]-3,3-dimethyl-piperazin-2-one hydrochloride Openeye Name: 6-benzhydryl-4-[[2-methoxy-5-[5-(trifluoromethyl)tetrazol-1-yl]phenyl]methyl]-3,3-dimethyl-piperazin-2-one hydrochloride CAS Name: 6-(diphenylmethyl)-4-[[2-methoxy-5-[5-(trifluoromethyl)-1-tetrazolyl]phenyl]methyl]-3,3-dimethyl-2-piperazinone hydrochloride IUPAC Name: 6-benzhydryl-4-[[2-methoxy-5-[5-(trifluoromethyl)tetrazol-1-yl]phenyl]methyl]-3,3-dimethylpiperazin-2-one hydrochloride Traditional Name: 6-benzhydryl-4-[2-methoxy-5-[5-(trifluoromethyl)tetrazol-1-yl]benzyl]-3,3-dimethyl-piperazin-2-one hydrochloride Formula: C29H30ClF3N6O2 MolecularWeight: 587.03571

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC(CN1CC2=C(C=CC(=C2)N3C(=NN=N3)C(F)(F)F)OC)C(C4=CC=CC=C4)C5=CC=CC=C5)C.Cl

Isomeric SMILES

CC1(C(=O)NC(CN1CC2=C(C=CC(=C2)N3C(=NN=N3)C(F)(F)F)OC)C(C4=CC=CC=C4)C5=CC=CC=C5)C.Cl

InChI

InChI=1S/C29H29F3N6O2.ClH/c1-28(2)27(39)33-23(25(19-10-6-4-7-11-19)20-12-8-5-9-13-20)18-37(28)17-21-16-22(14-15-24(21)40-3)38-26(29(30,31)32)34-35-36-38;/h4-16,23,25H,17-18H2,1-3H3,(H,33,39);1H