1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-(4-ethanoylphenoxy)ethanone

Systemtic Name: 1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-2-(4-ethanoylphenoxy)ethanone Openeye Name: 2-(4-acetylphenoxy)-1-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]ethanone CAS Name: 2-(4-acetylphenoxy)-1-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-acetylphenoxy)-1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]ethanone Traditional Name: 2-(4-acetylphenoxy)-1-[4-(5-chloro-2-methyl-phenyl)piperazino]ethanone Formula: C21H23ClN2O3 MolecularWeight: 386.87192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)COC3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H23ClN2O3/c1-15-3-6-18(22)13-20(15)23-9-11-24(12-10-23)21(26)14-27-19-7-4-17(5-8-19)16(2)25/h3-8,13H,9-12,14H2,1-2H3