methyl 2-[1-[[2-(4-cyanophenyl)-6-oxidanylidene-1H-pyrimidin-5-yl]carbonyl]piperidin-4-yl]ethanoate

Systemtic Name: methyl 2-[1-[[2-(4-cyanophenyl)-6-oxidanylidene-1H-pyrimidin-5-yl]carbonyl]piperidin-4-yl]ethanoate Openeye Name: methyl 2-[1-[2-(4-cyanophenyl)-6-oxo-1H-pyrimidine-5-carbonyl]-4-piperidyl]acetate CAS Name: 2-[1-[[2-(4-cyanophenyl)-6-oxo-1H-pyrimidin-5-yl]-oxomethyl]-4-piperidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-[2-(4-cyanophenyl)-6-oxo-1H-pyrimidine-5-carbonyl]piperidin-4-yl]acetate Traditional Name: 2-[1-[2-(4-cyanophenyl)-6-keto-1H-pyrimidine-5-carbonyl]-4-piperidyl]acetic acid methyl ester Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CCN(CC1)C(=O)C2=CN=C(NC2=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

COC(=O)CC1CCN(CC1)C(=O)C2=CN=C(NC2=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H20N4O4/c1-28-17(25)10-13-6-8-24(9-7-13)20(27)16-12-22-18(23-19(16)26)15-4-2-14(11-21)3-5-15/h2-5,12-13H,6-10H2,1H3,(H,22,23,26)