methyl 4-oxidanylidene-5-(phenylcarbonyloxy)-2-[phenyl(piperidin-1-yl)methyl]-1H-pyrimidine-6-carboxylate

Systemtic Name: methyl 4-oxidanylidene-5-(phenylcarbonyloxy)-2-[phenyl(piperidin-1-yl)methyl]-1H-pyrimidine-6-carboxylate Openeye Name: methyl 5-benzoyloxy-4-oxo-2-[phenyl(1-piperidyl)methyl]-1H-pyrimidine-6-carboxylate CAS Name: 5-benzoyloxy-4-oxo-2-[phenyl(1-piperidinyl)methyl]-1H-pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 5-benzoyloxy-4-oxo-2-[phenyl(piperidin-1-yl)methyl]-1H-pyrimidine-6-carboxylate Traditional Name: 5-benzoyloxy-4-keto-2-[phenyl(piperidino)methyl]-1H-pyrimidine-6-carboxylic acid methyl ester Formula: C25H25N3O5 MolecularWeight: 447.4831

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=O)N=C(N1)C(C2=CC=CC=C2)N3CCCCC3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(C(=O)N=C(N1)C(C2=CC=CC=C2)N3CCCCC3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H25N3O5/c1-32-25(31)19-21(33-24(30)18-13-7-3-8-14-18)23(29)27-22(26-19)20(17-11-5-2-6-12-17)28-15-9-4-10-16-28/h2-3,5-8,11-14,20H,4,9-10,15-16H2,1H3,(H,26,27,29)