phenethyl (4R)-4-(3-bromanyl-2,5-dimethoxy-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: phenethyl (4R)-4-(3-bromanyl-2,5-dimethoxy-phenyl)-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: phenethyl (4R)-4-(3-bromo-2,5-dimethoxy-phenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4R)-4-(3-bromo-2,5-dimethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid phenethyl ester IUPAC Name: phenethyl (4R)-4-(3-bromo-2,5-dimethoxyphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4R)-4-(3-bromo-2,5-dimethoxy-phenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid phenethyl ester Formula: C22H23BrN2O5 MolecularWeight: 475.33242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1)C2=CC(=CC(=C2OC)Br)OC)C(=O)OCCC3=CC=CC=C3

Isomeric SMILES

CC1=C([C@H](NC(=O)N1)C2=CC(=CC(=C2OC)Br)OC)C(=O)OCCC3=CC=CC=C3

InChI

InChI=1S/C22H23BrN2O5/c1-13-18(21(26)30-10-9-14-7-5-4-6-8-14)19(25-22(27)24-13)16-11-15(28-2)12-17(23)20(16)29-3/h4-8,11-12,19H,9-10H2,1-3H3,(H2,24,25,27)/t19-/m1/s1