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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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