4-nitro-2-[(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methyl]isoindole-1,3-dione

Systemtic Name: 4-nitro-2-[(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methyl]isoindole-1,3-dione Openeye Name: 4-nitro-2-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]isoindoline-1,3-dione CAS Name: 4-nitro-2-[(4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl]isoindole-1,3-dione IUPAC Name: 4-nitro-2-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]isoindole-1,3-dione Traditional Name: 2-[(4-ketopyrido[1,2-a]pyrimidin-2-yl)methyl]-4-nitro-isoindoline-1,3-quinone Formula: C17H10N4O5 MolecularWeight: 350.2851

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC(=CC(=O)N2C=C1)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=NC(=CC(=O)N2C=C1)CN3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C17H10N4O5/c22-14-8-10(18-13-6-1-2-7-19(13)14)9-20-16(23)11-4-3-5-12(21(25)26)15(11)17(20)24/h1-8H,9H2