2-(3,5-dimethylphenoxy)-1-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3,5-dimethylphenoxy)-1-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]ethanone Openeye Name: 2-(3,5-dimethylphenoxy)-1-[4-[2-(2-pyridyl)ethyl]piperazin-1-yl]ethanone CAS Name: 2-(3,5-dimethylphenoxy)-1-[4-[2-(2-pyridinyl)ethyl]-1-piperazinyl]ethanone IUPAC Name: 2-(3,5-dimethylphenoxy)-1-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]ethanone Traditional Name: 2-(3,5-dimethylphenoxy)-1-[4-[2-(2-pyridyl)ethyl]piperazino]ethanone Formula: C21H27N3O2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)N2CCN(CC2)CCC3=CC=CC=N3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)N2CCN(CC2)CCC3=CC=CC=N3)C

InChI

InChI=1S/C21H27N3O2/c1-17-13-18(2)15-20(14-17)26-16-21(25)24-11-9-23(10-12-24)8-6-19-5-3-4-7-22-19/h3-5,7,13-15H,6,8-12,16H2,1-2H3