2-[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexoxy]-1-[4-(2-pyridyl)piperazin-1-yl]ethanone CAS Name: 2-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]oxy-1-[4-(2-pyridinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]oxy-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexoxy]-1-[4-(2-pyridyl)piperazino]ethanone Formula: C21H33N3O2 MolecularWeight: 359.50562

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OCC(=O)N2CCN(CC2)C3=CC=CC=N3)C(C)C

Isomeric SMILES

C[C@H]1CC[C@@H]([C@H](C1)OCC(=O)N2CCN(CC2)C3=CC=CC=N3)C(C)C

InChI

InChI=1S/C21H33N3O2/c1-16(2)18-8-7-17(3)14-19(18)26-15-21(25)24-12-10-23(11-13-24)20-6-4-5-9-22-20/h4-6,9,16-19H,7-8,10-15H2,1-3H3/t17-,18+,19-/m0/s1