1-[[2-oxidanylidene-3-(1-pyridazin-4-ylpiperidin-4-yl)-1,3-oxazolidin-5-yl]methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[[2-oxidanylidene-3-(1-pyridazin-4-ylpiperidin-4-yl)-1,3-oxazolidin-5-yl]methyl]piperidine-4-carboxylic acid Openeye Name: 1-[[2-oxo-3-(1-pyridazin-4-yl-4-piperidyl)oxazolidin-5-yl]methyl]piperidine-4-carboxylic acid CAS Name: 1-[[2-oxo-3-[1-(4-pyridazinyl)-4-piperidinyl]-5-oxazolidinyl]methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[[2-oxo-3-(1-pyridazin-4-ylpiperidin-4-yl)-1,3-oxazolidin-5-yl]methyl]piperidine-4-carboxylic acid Traditional Name: 1-[[2-keto-3-(1-pyridazin-4-yl-4-piperidyl)oxazolidin-5-yl]methyl]isonipecotic acid Formula: C19H27N5O4 MolecularWeight: 389.44878

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)CC2CN(C(=O)O2)C3CCN(CC3)C4=CN=NC=C4

Isomeric SMILES

C1CN(CCC1C(=O)O)CC2CN(C(=O)O2)C3CCN(CC3)C4=CN=NC=C4

InChI

InChI=1S/C19H27N5O4/c25-18(26)14-2-7-22(8-3-14)12-17-13-24(19(27)28-17)15-4-9-23(10-5-15)16-1-6-20-21-11-16/h1,6,11,14-15,17H,2-5,7-10,12-13H2,(H,25,26)