2-(2-chloranyl-4-phenyl-phenoxy)-1-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]ethanone

Systemtic Name: 2-(2-chloranyl-4-phenyl-phenoxy)-1-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]ethanone Openeye Name: 2-(2-chloro-4-phenyl-phenoxy)-1-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]ethanone CAS Name: 2-(2-chloro-4-phenylphenoxy)-1-[4-[(3,4-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 2-(2-chloro-4-phenylphenoxy)-1-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]ethanone Traditional Name: 2-(2-chloro-4-phenyl-phenoxy)-1-(4-veratroylpiperazino)ethanone Formula: C27H27ClN2O5 MolecularWeight: 494.96668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)COC3=C(C=C(C=C3)C4=CC=CC=C4)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C(=O)COC3=C(C=C(C=C3)C4=CC=CC=C4)Cl)OC

InChI

InChI=1S/C27H27ClN2O5/c1-33-24-11-9-21(17-25(24)34-2)27(32)30-14-12-29(13-15-30)26(31)18-35-23-10-8-20(16-22(23)28)19-6-4-3-5-7-19/h3-11,16-17H,12-15,18H2,1-2H3