[2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] 1-pyrimidin-2-ylpiperidine-2-carboxylate

Systemtic Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxidanylidene-ethyl] 1-pyrimidin-2-ylpiperidine-2-carboxylate Openeye Name: (2-indan-5-yl-2-oxo-ethyl) 1-pyrimidin-2-ylpiperidine-2-carboxylate CAS Name: 1-(2-pyrimidinyl)-2-piperidinecarboxylic acid [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] 1-pyrimidin-2-ylpiperidine-2-carboxylate Traditional Name: 1-(2-pyrimidyl)pipecolinic acid (2-indan-5-yl-2-keto-ethyl) ester Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)OCC(=O)C2=CC3=C(CCC3)C=C2)C4=NC=CC=N4

Isomeric SMILES

C1CCN(C(C1)C(=O)OCC(=O)C2=CC3=C(CCC3)C=C2)C4=NC=CC=N4

InChI

InChI=1S/C21H23N3O3/c25-19(17-9-8-15-5-3-6-16(15)13-17)14-27-20(26)18-7-1-2-12-24(18)21-22-10-4-11-23-21/h4,8-11,13,18H,1-3,5-7,12,14H2