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

Systemtic Name: 1-[[2-oxidanylidene-3-[2-(1-pyridin-4-ylpiperidin-4-yl)ethyl]-1,3-oxazolidin-5-yl]methyl]piperidine-4-carboxylic acid Openeye Name: 1-[[2-oxo-3-[2-[1-(4-pyridyl)-4-piperidyl]ethyl]oxazolidin-5-yl]methyl]piperidine-4-carboxylic acid CAS Name: 1-[[2-oxo-3-[2-(1-pyridin-4-yl-4-piperidinyl)ethyl]-5-oxazolidinyl]methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[[2-oxo-3-[2-(1-pyridin-4-ylpiperidin-4-yl)ethyl]-1,3-oxazolidin-5-yl]methyl]piperidine-4-carboxylic acid Traditional Name: 1-[[2-keto-3-[2-[1-(4-pyridyl)-4-piperidyl]ethyl]oxazolidin-5-yl]methyl]isonipecotic acid Formula: C22H32N4O4 MolecularWeight: 416.51388

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCN2CC(OC2=O)CN3CCC(CC3)C(=O)O)C4=CC=NC=C4

Isomeric SMILES

C1CN(CCC1CCN2CC(OC2=O)CN3CCC(CC3)C(=O)O)C4=CC=NC=C4

InChI

InChI=1S/C22H32N4O4/c27-21(28)18-6-10-24(11-7-18)15-20-16-26(22(29)30-20)14-5-17-3-12-25(13-4-17)19-1-8-23-9-2-19/h1-2,8-9,17-18,20H,3-7,10-16H2,(H,27,28)