4-[[2-oxidanylidene-3-(4-pyridin-4-ylpiperazin-1-yl)propyl]amino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[2-oxidanylidene-3-(4-pyridin-4-ylpiperazin-1-yl)propyl]amino]cyclohexane-1-carboxylic acid Openeye Name: 4-[[2-oxo-3-[4-(4-pyridyl)piperazin-1-yl]propyl]amino]cyclohexanecarboxylic acid CAS Name: 4-[[2-oxo-3-(4-pyridin-4-yl-1-piperazinyl)propyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[2-oxo-3-(4-pyridin-4-ylpiperazin-1-yl)propyl]amino]cyclohexane-1-carboxylic acid Traditional Name: 4-[[2-keto-3-[4-(4-pyridyl)piperazino]propyl]amino]cyclohexanecarboxylic acid Formula: C19H28N4O3 MolecularWeight: 360.45062

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)O)NCC(=O)CN2CCN(CC2)C3=CC=NC=C3

Isomeric SMILES

C1CC(CCC1C(=O)O)NCC(=O)CN2CCN(CC2)C3=CC=NC=C3

InChI

InChI=1S/C19H28N4O3/c24-18(13-21-16-3-1-15(2-4-16)19(25)26)14-22-9-11-23(12-10-22)17-5-7-20-8-6-17/h5-8,15-16,21H,1-4,9-14H2,(H,25,26)