ethyl (4R)-6-[[(5S,7R)-3-bromanyl-1-adamantyl]carbonyloxymethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4R)-6-[[(5S,7R)-3-bromanyl-1-adamantyl]carbonyloxymethyl]-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4R)-6-[[(5S,7R)-3-bromoadamantane-1-carbonyl]oxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-6-[[[(5S,7R)-3-bromo-1-adamantyl]-oxomethoxy]methyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-6-[[(5S,7R)-3-bromoadamantane-1-carbonyl]oxymethyl]-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-6-[[(5S,7R)-3-bromoadamantane-1-carbonyl]oxymethyl]-2-keto-4-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H27BrN2O5 MolecularWeight: 455.34278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)COC(=O)C23CC4CC(C2)CC(C4)(C3)Br

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@@H]1C)COC(=O)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)Br

InChI

InChI=1S/C20H27BrN2O5/c1-3-27-16(24)15-11(2)22-18(26)23-14(15)9-28-17(25)19-5-12-4-13(6-19)8-20(21,7-12)10-19/h11-13H,3-10H2,1-2H3,(H2,22,23,26)/t11-,12-,13+,19?,20?/m1/s1