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

Systemtic Name: ethyl 1-[2-[4-(4-ethoxyphenyl)-6-oxidanylidene-pyrimidin-1-yl]ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[4-(4-ethoxyphenyl)-6-oxo-pyrimidin-1-yl]acetyl]piperidine-4-carboxylate CAS Name: 1-[2-[4-(4-ethoxyphenyl)-6-oxo-1-pyrimidinyl]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[4-(4-ethoxyphenyl)-6-oxopyrimidin-1-yl]acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(6-keto-4-p-phenetyl-pyrimidin-1-yl)acetyl]isonipecotic acid ethyl ester Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CC(=O)N(C=N2)CC(=O)N3CCC(CC3)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CC(=O)N(C=N2)CC(=O)N3CCC(CC3)C(=O)OCC

InChI

InChI=1S/C22H27N3O5/c1-3-29-18-7-5-16(6-8-18)19-13-20(26)25(15-23-19)14-21(27)24-11-9-17(10-12-24)22(28)30-4-2/h5-8,13,15,17H,3-4,9-12,14H2,1-2H3