2-(3-methyl-4-propan-2-yl-phenoxy)-1-(4-pyridin-4-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-(3-methyl-4-propan-2-yl-phenoxy)-1-(4-pyridin-4-ylpiperazin-1-yl)ethanone Openeye Name: 2-(4-isopropyl-3-methyl-phenoxy)-1-[4-(4-pyridyl)piperazin-1-yl]ethanone CAS Name: 2-(3-methyl-4-propan-2-ylphenoxy)-1-(4-pyridin-4-yl-1-piperazinyl)ethanone IUPAC Name: 2-(3-methyl-4-propan-2-ylphenoxy)-1-(4-pyridin-4-ylpiperazin-1-yl)ethanone Traditional Name: 2-(4-isopropyl-3-methyl-phenoxy)-1-[4-(4-pyridyl)piperazino]ethanone Formula: C21H27N3O2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O2/c1-16(2)20-5-4-19(14-17(20)3)26-15-21(25)24-12-10-23(11-13-24)18-6-8-22-9-7-18/h4-9,14,16H,10-13,15H2,1-3H3