2-[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]-5-(4-nitrophenyl)carbonyl-isoindole-1,3-dione

Systemtic Name: 2-[2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]-5-(4-nitrophenyl)carbonyl-isoindole-1,3-dione Openeye Name: 2-(2,4-dioxo-1H-pyrimidin-5-yl)-5-(4-nitrobenzoyl)isoindoline-1,3-dione CAS Name: 2-(2,4-dioxo-1H-pyrimidin-5-yl)-5-[(4-nitrophenyl)-oxomethyl]isoindole-1,3-dione IUPAC Name: 2-(2,4-dioxo-1H-pyrimidin-5-yl)-5-(4-nitrobenzoyl)isoindole-1,3-dione Traditional Name: 2-(2,4-diketo-1H-pyrimidin-5-yl)-5-(4-nitrobenzoyl)isoindoline-1,3-quinone Formula: C19H10N4O7 MolecularWeight: 406.3053

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CNC(=O)NC4=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CNC(=O)NC4=O)[N+](=O)[O-]

InChI

InChI=1S/C19H10N4O7/c24-15(9-1-4-11(5-2-9)23(29)30)10-3-6-12-13(7-10)18(27)22(17(12)26)14-8-20-19(28)21-16(14)25/h1-8H,(H2,20,21,25,28)