2-[[3,5-bis(phenylmethoxy)phenyl]methyl-tert-butyl-amino]-1-phenyl-ethanone hydrobromide

Systemtic Name: 2-[[3,5-bis(phenylmethoxy)phenyl]methyl-tert-butyl-amino]-1-phenyl-ethanone hydrobromide Openeye Name: 2-[tert-butyl-[(3,5-dibenzyloxyphenyl)methyl]amino]-1-phenyl-ethanone hydrobromide CAS Name: 2-[[3,5-bis(phenylmethoxy)phenyl]methyl-tert-butylamino]-1-phenylethanone hydrobromide IUPAC Name: 2-[[3,5-bis(phenylmethoxy)phenyl]methyl-tert-butylamino]-1-phenylethanone hydrobromide Traditional Name: 2-[tert-butyl-(3,5-dibenzoxybenzyl)amino]-1-phenyl-ethanone hydrobromide Formula: C33H36BrNO3 MolecularWeight: 574.54784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CC1=CC(=CC(=C1)OCC2=CC=CC=C2)OCC3=CC=CC=C3)CC(=O)C4=CC=CC=C4.Br

Isomeric SMILES

CC(C)(C)N(CC1=CC(=CC(=C1)OCC2=CC=CC=C2)OCC3=CC=CC=C3)CC(=O)C4=CC=CC=C4.Br

InChI

InChI=1S/C33H35NO3.BrH/c1-33(2,3)34(23-32(35)29-17-11-6-12-18-29)22-28-19-30(36-24-26-13-7-4-8-14-26)21-31(20-28)37-25-27-15-9-5-10-16-27;/h4-21H,22-25H2,1-3H3;1H