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

Systemtic Name: 1-[[2-oxidanylidene-4-pentyl-3-(1-pyridin-4-ylpiperidin-4-yl)-1,3-oxazolidin-5-yl]methyl]piperidine-4-carboxylic acid Openeye Name: 1-[[2-oxo-4-pentyl-3-[1-(4-pyridyl)-4-piperidyl]oxazolidin-5-yl]methyl]piperidine-4-carboxylic acid CAS Name: 1-[[2-oxo-4-pentyl-3-(1-pyridin-4-yl-4-piperidinyl)-5-oxazolidinyl]methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[[2-oxo-4-pentyl-3-(1-pyridin-4-ylpiperidin-4-yl)-1,3-oxazolidin-5-yl]methyl]piperidine-4-carboxylic acid Traditional Name: 1-[[4-amyl-2-keto-3-[1-(4-pyridyl)-4-piperidyl]oxazolidin-5-yl]methyl]isonipecotic acid Formula: C25H38N4O4 MolecularWeight: 458.59362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(OC(=O)N1C2CCN(CC2)C3=CC=NC=C3)CN4CCC(CC4)C(=O)O

Isomeric SMILES

CCCCCC1C(OC(=O)N1C2CCN(CC2)C3=CC=NC=C3)CN4CCC(CC4)C(=O)O

InChI

InChI=1S/C25H38N4O4/c1-2-3-4-5-22-23(18-27-14-8-19(9-15-27)24(30)31)33-25(32)29(22)21-10-16-28(17-11-21)20-6-12-26-13-7-20/h6-7,12-13,19,21-23H,2-5,8-11,14-18H2,1H3,(H,30,31)