2-[1-[[2-oxidanylidene-3-(1-pyridin-4-ylpiperidin-4-yl)-1,3-oxazolidin-5-yl]methyl]piperidin-3-yl]ethanoic acid

Systemtic Name: 2-[1-[[2-oxidanylidene-3-(1-pyridin-4-ylpiperidin-4-yl)-1,3-oxazolidin-5-yl]methyl]piperidin-3-yl]ethanoic acid Openeye Name: 2-[1-[[2-oxo-3-[1-(4-pyridyl)-4-piperidyl]oxazolidin-5-yl]methyl]-3-piperidyl]acetic acid CAS Name: 2-[1-[[2-oxo-3-(1-pyridin-4-yl-4-piperidinyl)-5-oxazolidinyl]methyl]-3-piperidinyl]acetic acid IUPAC Name: 2-[1-[[2-oxo-3-(1-pyridin-4-ylpiperidin-4-yl)-1,3-oxazolidin-5-yl]methyl]piperidin-3-yl]acetic acid Traditional Name: 2-[1-[[2-keto-3-[1-(4-pyridyl)-4-piperidyl]oxazolidin-5-yl]methyl]-3-piperidyl]acetic acid Formula: C21H30N4O4 MolecularWeight: 402.4873

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2CN(C(=O)O2)C3CCN(CC3)C4=CC=NC=C4)CC(=O)O

Isomeric SMILES

C1CC(CN(C1)CC2CN(C(=O)O2)C3CCN(CC3)C4=CC=NC=C4)CC(=O)O

InChI

InChI=1S/C21H30N4O4/c26-20(27)12-16-2-1-9-23(13-16)14-19-15-25(21(28)29-19)18-5-10-24(11-6-18)17-3-7-22-8-4-17/h3-4,7-8,16,18-19H,1-2,5-6,9-15H2,(H,26,27)