2-[[[2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]methylamino]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[[2,4-bis(oxidanylidene)-1H-pyrimidin-6-yl]methylamino]methyl]isoindole-1,3-dione Openeye Name: 2-[[(2,4-dioxo-1H-pyrimidin-6-yl)methylamino]methyl]isoindoline-1,3-dione CAS Name: 2-[[(2,4-dioxo-1H-pyrimidin-6-yl)methylamino]methyl]isoindole-1,3-dione IUPAC Name: 2-[[(2,4-dioxo-1H-pyrimidin-6-yl)methylamino]methyl]isoindole-1,3-dione Traditional Name: 2-[[(2,4-diketo-1H-pyrimidin-6-yl)methylamino]methyl]isoindoline-1,3-quinone Formula: C14H12N4O4 MolecularWeight: 300.26948

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CNCC3=CC(=O)NC(=O)N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CNCC3=CC(=O)NC(=O)N3

InChI

InChI=1S/C14H12N4O4/c19-11-5-8(16-14(22)17-11)6-15-7-18-12(20)9-3-1-2-4-10(9)13(18)21/h1-5,15H,6-7H2,(H2,16,17,19,22)