ethyl (4S)-4-ethyl-6-(naphthalen-2-ylcarbonyloxymethyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-ethyl-6-(naphthalen-2-ylcarbonyloxymethyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-ethyl-6-(naphthalene-2-carbonyloxymethyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-ethyl-6-[[2-naphthalenyl(oxo)methoxy]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-ethyl-6-(naphthalene-2-carbonyloxymethyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-ethyl-2-keto-6-(2-naphthoyloxymethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)COC(=O)C2=CC3=CC=CC=C3C=C2)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)COC(=O)C2=CC3=CC=CC=C3C=C2)C(=O)OCC

InChI

InChI=1S/C21H22N2O5/c1-3-16-18(20(25)27-4-2)17(23-21(26)22-16)12-28-19(24)15-10-9-13-7-5-6-8-14(13)11-15/h5-11,16H,3-4,12H2,1-2H3,(H2,22,23,26)/t16-/m0/s1