ethyl 6-(1-adamantylcarbonyloxymethyl)-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(1-adamantylcarbonyloxymethyl)-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-(adamantane-1-carbonyloxymethyl)-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[1-adamantyl(oxo)methoxy]methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(adamantane-1-carbonyloxymethyl)-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-(adamantane-1-carbonyloxymethyl)-2-keto-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C25H30N2O5 MolecularWeight: 438.5161

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)COC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)COC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H30N2O5/c1-2-31-22(28)20-19(26-24(30)27-21(20)18-6-4-3-5-7-18)14-32-23(29)25-11-15-8-16(12-25)10-17(9-15)13-25/h3-7,15-17,21H,2,8-14H2,1H3,(H2,26,27,30)