ethyl 1-[2-[4-(4-fluorophenyl)-6-oxidanylidene-pyrimidin-1-yl]ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[4-(4-fluorophenyl)-6-oxidanylidene-pyrimidin-1-yl]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[4-(4-fluorophenyl)-6-oxo-pyrimidin-1-yl]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[4-(4-fluorophenyl)-6-oxo-1-pyrimidinyl]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[4-(4-fluorophenyl)-6-oxopyrimidin-1-yl]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[4-(4-fluorophenyl)-6-keto-pyrimidin-1-yl]acetyl]isonipecotic acid ethyl ester Formula: C20H22FN3O4 MolecularWeight: 387.404783

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CN2C=NC(=CC2=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CN2C=NC(=CC2=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FN3O4/c1-2-28-20(27)15-7-9-23(10-8-15)19(26)12-24-13-22-17(11-18(24)25)14-3-5-16(21)6-4-14/h3-6,11,13,15H,2,7-10,12H2,1H3