2-[5-[bis(chloranyl)methyl]-3-nitroso-1,4-dihydropyrazin-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[5-[bis(chloranyl)methyl]-3-nitroso-1,4-dihydropyrazin-2-yl]isoindole-1,3-dione Openeye Name: 2-[5-(dichloromethyl)-3-nitroso-1,4-dihydropyrazin-2-yl]isoindoline-1,3-dione CAS Name: 2-[5-(dichloromethyl)-3-nitroso-1,4-dihydropyrazin-2-yl]isoindole-1,3-dione IUPAC Name: 2-[5-(dichloromethyl)-3-nitroso-1,4-dihydropyrazin-2-yl]isoindole-1,3-dione Traditional Name: 2-[5-(dichloromethyl)-3-nitroso-1,4-dihydropyrazin-2-yl]isoindoline-1,3-quinone Formula: C13H8Cl2N4O3 MolecularWeight: 339.13362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=C(NC(=CN3)C(Cl)Cl)N=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=C(NC(=CN3)C(Cl)Cl)N=O

InChI

InChI=1S/C13H8Cl2N4O3/c14-9(15)8-5-16-11(10(17-8)18-22)19-12(20)6-3-1-2-4-7(6)13(19)21/h1-5,9,16-17H