1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-(2,5-ditert-butyl-4-methoxy-phenoxy)ethanone

Systemtic Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-(2,5-ditert-butyl-4-methoxy-phenoxy)ethanone Openeye Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-(2,5-ditert-butyl-4-methoxy-phenoxy)ethanone CAS Name: 1-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-2-(2,5-ditert-butyl-4-methoxyphenoxy)ethanone IUPAC Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-(2,5-ditert-butyl-4-methoxyphenoxy)ethanone Traditional Name: 1-[4-(4-chlorobenzyl)piperazino]-2-(2,5-ditert-butyl-4-methoxy-phenoxy)ethanone Formula: C28H39ClN2O3 MolecularWeight: 487.07386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1OCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)C(C)(C)C)OC

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1OCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl)C(C)(C)C)OC

InChI

InChI=1S/C28H39ClN2O3/c1-27(2,3)22-17-25(23(28(4,5)6)16-24(22)33-7)34-19-26(32)31-14-12-30(13-15-31)18-20-8-10-21(29)11-9-20/h8-11,16-17H,12-15,18-19H2,1-7H3