[2-oxidanylidene-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl] 1-pyrimidin-2-ylpiperidine-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl] 1-pyrimidin-2-ylpiperidine-2-carboxylate Openeye Name: (2-oxo-2-tetralin-6-yl-ethyl) 1-pyrimidin-2-ylpiperidine-2-carboxylate CAS Name: 1-(2-pyrimidinyl)-2-piperidinecarboxylic acid [2-oxo-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl] 1-pyrimidin-2-ylpiperidine-2-carboxylate Traditional Name: 1-(2-pyrimidyl)pipecolinic acid (2-keto-2-tetralin-6-yl-ethyl) ester Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)OCC(=O)C2=CC3=C(CCCC3)C=C2)C4=NC=CC=N4

Isomeric SMILES

C1CCN(C(C1)C(=O)OCC(=O)C2=CC3=C(CCCC3)C=C2)C4=NC=CC=N4

InChI

InChI=1S/C22H25N3O3/c26-20(18-10-9-16-6-1-2-7-17(16)14-18)15-28-21(27)19-8-3-4-13-25(19)22-23-11-5-12-24-22/h5,9-12,14,19H,1-4,6-8,13,15H2