1-[4-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]piperazin-1-yl]-2-(3-methylphenoxy)ethanone

Systemtic Name: 1-[4-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]piperazin-1-yl]-2-(3-methylphenoxy)ethanone Openeye Name: 1-[4-[(4-hydroxy-3,5-dimethoxy-phenyl)methyl]piperazin-1-yl]-2-(3-methylphenoxy)ethanone CAS Name: 1-[4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-1-piperazinyl]-2-(3-methylphenoxy)ethanone IUPAC Name: 1-[4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]piperazin-1-yl]-2-(3-methylphenoxy)ethanone Traditional Name: 1-[4-(4-hydroxy-3,5-dimethoxy-benzyl)piperazino]-2-(3-methylphenoxy)ethanone Formula: C22H28N2O5 MolecularWeight: 400.46812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)N2CCN(CC2)CC3=CC(=C(C(=C3)OC)O)OC

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)N2CCN(CC2)CC3=CC(=C(C(=C3)OC)O)OC

InChI

InChI=1S/C22H28N2O5/c1-16-5-4-6-18(11-16)29-15-21(25)24-9-7-23(8-10-24)14-17-12-19(27-2)22(26)20(13-17)28-3/h4-6,11-13,26H,7-10,14-15H2,1-3H3