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

Systemtic Name: 1-[2-[2-oxidanylidene-3-(1-pyridin-4-ylpiperidin-4-yl)-1,3-oxazolidin-5-yl]ethanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-[2-oxo-3-[1-(4-pyridyl)-4-piperidyl]oxazolidin-5-yl]acetyl]piperidine-4-carboxylic acid CAS Name: 1-[1-oxo-2-[2-oxo-3-(1-pyridin-4-yl-4-piperidinyl)-5-oxazolidinyl]ethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-[2-oxo-3-(1-pyridin-4-ylpiperidin-4-yl)-1,3-oxazolidin-5-yl]acetyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-[2-keto-3-[1-(4-pyridyl)-4-piperidyl]oxazolidin-5-yl]acetyl]isonipecotic acid Formula: C21H28N4O5 MolecularWeight: 416.47082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N4O5/c26-19(24-9-3-15(4-10-24)20(27)28)13-18-14-25(21(29)30-18)17-5-11-23(12-6-17)16-1-7-22-8-2-16/h1-2,7-8,15,17-18H,3-6,9-14H2,(H,27,28)