2-(azepan-1-yl)-1-[(3R,4R)-4-(4-methylpiperazin-1-yl)-3-oxidanyl-piperidin-1-yl]ethanone

Systemtic Name: 2-(azepan-1-yl)-1-[(3R,4R)-4-(4-methylpiperazin-1-yl)-3-oxidanyl-piperidin-1-yl]ethanone Openeye Name: 2-(azepan-1-yl)-1-[(3R,4R)-3-hydroxy-4-(4-methylpiperazin-1-yl)-1-piperidyl]ethanone CAS Name: 2-(1-azepanyl)-1-[(3R,4R)-3-hydroxy-4-(4-methyl-1-piperazinyl)-1-piperidinyl]ethanone IUPAC Name: 2-(azepan-1-yl)-1-[(3R,4R)-3-hydroxy-4-(4-methylpiperazin-1-yl)piperidin-1-yl]ethanone Traditional Name: 2-(azepan-1-yl)-1-[(3R,4R)-3-hydroxy-4-(4-methylpiperazino)piperidino]ethanone Formula: C18H34N4O2 MolecularWeight: 338.48816

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CCN(CC2O)C(=O)CN3CCCCCC3

Isomeric SMILES

CN1CCN(CC1)[C@@H]2CCN(C[C@H]2O)C(=O)CN3CCCCCC3

InChI

InChI=1S/C18H34N4O2/c1-19-10-12-21(13-11-19)16-6-9-22(14-17(16)23)18(24)15-20-7-4-2-3-5-8-20/h16-17,23H,2-15H2,1H3/t16-,17-/m1/s1