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

Systemtic Name: ethyl (4S)-6-[(4-ethanoyl-1-methyl-pyrrol-2-yl)carbonyloxymethyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-6-[(4-acetyl-1-methyl-pyrrole-2-carbonyl)oxymethyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[[(4-acetyl-1-methyl-2-pyrrolyl)-oxomethoxy]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-[(4-acetyl-1-methylpyrrole-2-carbonyl)oxymethyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-[(4-acetyl-1-methyl-pyrrole-2-carbonyl)oxymethyl]-4-ethyl-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H23N3O6 MolecularWeight: 377.39172

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)COC(=O)C2=CC(=CN2C)C(=O)C)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)COC(=O)C2=CC(=CN2C)C(=O)C)C(=O)OCC

InChI

InChI=1S/C18H23N3O6/c1-5-12-15(17(24)26-6-2)13(20-18(25)19-12)9-27-16(23)14-7-11(10(3)22)8-21(14)4/h7-8,12H,5-6,9H2,1-4H3,(H2,19,20,25)/t12-/m0/s1