2-nitro-4-[(4R)-2-oxidanylidene-6-phenyl-5-(phenylcarbonyl)-3,4-dihydro-1H-pyrimidin-4-yl]phenolate

Systemtic Name: 2-nitro-4-[(4R)-2-oxidanylidene-6-phenyl-5-(phenylcarbonyl)-3,4-dihydro-1H-pyrimidin-4-yl]phenolate Openeye Name: 4-[(4R)-5-benzoyl-2-oxo-6-phenyl-3,4-dihydro-1H-pyrimidin-4-yl]-2-nitro-phenolate CAS Name: 4-[(4R)-5-benzoyl-2-oxo-6-phenyl-3,4-dihydro-1H-pyrimidin-4-yl]-2-nitrophenolate IUPAC Name: 4-[(4R)-5-benzoyl-2-oxo-6-phenyl-3,4-dihydro-1H-pyrimidin-4-yl]-2-nitrophenolate Traditional Name: 4-[(4R)-5-benzoyl-2-keto-6-phenyl-3,4-dihydro-1H-pyrimidin-4-yl]-2-nitro-phenolate Formula: C23H16N3O5- MolecularWeight: 414.39024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(NC(=O)N2)C3=CC(=C(C=C3)[O-])[N+](=O)[O-])C(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C([C@H](NC(=O)N2)C3=CC(=C(C=C3)[O-])[N+](=O)[O-])C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H17N3O5/c27-18-12-11-16(13-17(18)26(30)31)21-19(22(28)15-9-5-2-6-10-15)20(24-23(29)25-21)14-7-3-1-4-8-14/h1-13,21,27H,(H2,24,25,29)/p-1/t21-/m1/s1