methyl 2-[1-[2-(4-cyanophenyl)pyrimidin-5-yl]carbonylpiperidin-4-yl]ethanoate

Systemtic Name: methyl 2-[1-[2-(4-cyanophenyl)pyrimidin-5-yl]carbonylpiperidin-4-yl]ethanoate Openeye Name: methyl 2-[1-[2-(4-cyanophenyl)pyrimidine-5-carbonyl]-4-piperidyl]acetate CAS Name: 2-[1-[[2-(4-cyanophenyl)-5-pyrimidinyl]-oxomethyl]-4-piperidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-[2-(4-cyanophenyl)pyrimidine-5-carbonyl]piperidin-4-yl]acetate Traditional Name: 2-[1-[2-(4-cyanophenyl)pyrimidine-5-carbonyl]-4-piperidyl]acetic acid methyl ester Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N4O3/c1-27-18(25)10-14-6-8-24(9-7-14)20(26)17-12-22-19(23-13-17)16-4-2-15(11-21)3-5-16/h2-5,12-14H,6-10H2,1H3