4-[2-(4-pyridin-4-ylpiperazin-1-yl)ethanoylamino]cyclohexane-1-carboxylate

Systemtic Name: 4-[2-(4-pyridin-4-ylpiperazin-1-yl)ethanoylamino]cyclohexane-1-carboxylate Openeye Name: 4-[[2-[4-(4-pyridyl)piperazin-1-yl]acetyl]amino]cyclohexanecarboxylate CAS Name: 4-[[1-oxo-2-(4-pyridin-4-yl-1-piperazinyl)ethyl]amino]-1-cyclohexanecarboxylate IUPAC Name: 4-[[2-(4-pyridin-4-ylpiperazin-1-yl)acetyl]amino]cyclohexane-1-carboxylate Traditional Name: 4-[[2-[4-(4-pyridyl)piperazino]acetyl]amino]cyclohexanecarboxylate Formula: C18H25N4O3- MolecularWeight: 345.4161

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)[O-])NC(=O)CN2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

C1CC(CCC1C(=O)[O-])NC(=O)CN2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C18H26N4O3/c23-17(20-15-3-1-14(2-4-15)18(24)25)13-21-9-11-22(12-10-21)16-5-7-19-8-6-16/h5-8,14-15H,1-4,9-13H2,(H,20,23)(H,24,25)/p-1