[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 1-pyrimidin-2-ylpiperidine-2-carboxylate

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] 1-pyrimidin-2-ylpiperidine-2-carboxylate Openeye Name: [2-(4-methoxyphenyl)-2-oxo-ethyl] 1-pyrimidin-2-ylpiperidine-2-carboxylate CAS Name: 1-(2-pyrimidinyl)-2-piperidinecarboxylic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl] 1-pyrimidin-2-ylpiperidine-2-carboxylate Traditional Name: 1-(2-pyrimidyl)pipecolinic acid [2-keto-2-(4-methoxyphenyl)ethyl] ester Formula: C19H21N3O4 MolecularWeight: 355.38774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)COC(=O)C2CCCCN2C3=NC=CC=N3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)COC(=O)C2CCCCN2C3=NC=CC=N3

InChI

InChI=1S/C19H21N3O4/c1-25-15-8-6-14(7-9-15)17(23)13-26-18(24)16-5-2-3-12-22(16)19-20-10-4-11-21-19/h4,6-11,16H,2-3,5,12-13H2,1H3