ethyl 4-ethyl-2-oxidanylidene-6-[(2-phenoxypyridin-3-yl)carbonyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-ethyl-2-oxidanylidene-6-[(2-phenoxypyridin-3-yl)carbonyloxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-ethyl-2-oxo-6-[(2-phenoxypyridine-3-carbonyl)oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-ethyl-2-oxo-6-[[oxo-(2-phenoxy-3-pyridinyl)methoxy]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-2-oxo-6-[(2-phenoxypyridine-3-carbonyl)oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-ethyl-2-keto-6-[(2-phenoxynicotinoyl)oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H23N3O6 MolecularWeight: 425.43452

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)COC(=O)C2=C(N=CC=C2)OC3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCC1C(=C(NC(=O)N1)COC(=O)C2=C(N=CC=C2)OC3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C22H23N3O6/c1-3-16-18(21(27)29-4-2)17(25-22(28)24-16)13-30-20(26)15-11-8-12-23-19(15)31-14-9-6-5-7-10-14/h5-12,16H,3-4,13H2,1-2H3,(H2,24,25,28)