2-(diphenylmethyl)-N-[[2-methoxy-5-(trifluoromethyloxy)phenyl]methyl]azepan-3-amine

Systemtic Name: 2-(diphenylmethyl)-N-[[2-methoxy-5-(trifluoromethyloxy)phenyl]methyl]azepan-3-amine Openeye Name: 2-benzhydryl-N-[[2-methoxy-5-(trifluoromethoxy)phenyl]methyl]azepan-3-amine CAS Name: 2-(diphenylmethyl)-N-[[2-methoxy-5-(trifluoromethoxy)phenyl]methyl]-3-azepanamine IUPAC Name: 2-benzhydryl-N-[[2-methoxy-5-(trifluoromethoxy)phenyl]methyl]azepan-3-amine Traditional Name: (2-benzhydrylazepan-3-yl)-[2-methoxy-5-(trifluoromethoxy)benzyl]amine Formula: C28H31F3N2O2 MolecularWeight: 484.55315

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)OC(F)(F)F)CNC2CCCCNC2C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)OC(F)(F)F)CNC2CCCCNC2C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H31F3N2O2/c1-34-25-16-15-23(35-28(29,30)31)18-22(25)19-33-24-14-8-9-17-32-27(24)26(20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2-7,10-13,15-16,18,24,26-27,32-33H,8-9,14,17,19H2,1H3