2-[(6R)-5-ethoxycarbonyl-3-methyl-2-oxidanylidene-4-phenyl-1,6-dihydropyrimidin-6-yl]-4-nitro-phenolate

Systemtic Name: 2-[(6R)-5-ethoxycarbonyl-3-methyl-2-oxidanylidene-4-phenyl-1,6-dihydropyrimidin-6-yl]-4-nitro-phenolate Openeye Name: 2-[(6R)-5-ethoxycarbonyl-3-methyl-2-oxo-4-phenyl-1,6-dihydropyrimidin-6-yl]-4-nitro-phenolate CAS Name: 2-[(6R)-5-ethoxycarbonyl-3-methyl-2-oxo-4-phenyl-1,6-dihydropyrimidin-6-yl]-4-nitrophenolate IUPAC Name: 2-[(6R)-5-ethoxycarbonyl-3-methyl-2-oxo-4-phenyl-1,6-dihydropyrimidin-6-yl]-4-nitrophenolate Traditional Name: 2-[(6R)-5-carbethoxy-2-keto-3-methyl-4-phenyl-1,6-dihydropyrimidin-6-yl]-4-nitro-phenolate Formula: C20H18N3O6- MolecularWeight: 396.37342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=C(C=CC(=C2)[N+](=O)[O-])[O-])C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)N[C@@H]1C2=C(C=CC(=C2)[N+](=O)[O-])[O-])C)C3=CC=CC=C3

InChI

InChI=1S/C20H19N3O6/c1-3-29-19(25)16-17(14-11-13(23(27)28)9-10-15(14)24)21-20(26)22(2)18(16)12-7-5-4-6-8-12/h4-11,17,24H,3H2,1-2H3,(H,21,26)/p-1/t17-/m1/s1