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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(=O)N2CCN(CC2)CCC3=CC=NC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC(=O)N2CCN(CC2)CCC3=CC=NC=C3)C

InChI

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