6-(2-chloranyl-5-nitro-phenyl)-2,3-dimethyl-pyrrolo[3,4-b]pyrazine-5,7-dione

Systemtic Name: 6-(2-chloranyl-5-nitro-phenyl)-2,3-dimethyl-pyrrolo[3,4-b]pyrazine-5,7-dione Openeye Name: 6-(2-chloro-5-nitro-phenyl)-2,3-dimethyl-pyrrolo[3,4-b]pyrazine-5,7-dione CAS Name: 6-(2-chloro-5-nitrophenyl)-2,3-dimethylpyrrolo[3,4-b]pyrazine-5,7-dione IUPAC Name: 6-(2-chloro-5-nitrophenyl)-2,3-dimethylpyrrolo[3,4-b]pyrazine-5,7-dione Traditional Name: 6-(2-chloro-5-nitro-phenyl)-2,3-dimethyl-pyrrolo[3,4-b]pyrazine-5,7-quinone Formula: C14H9ClN4O4 MolecularWeight: 332.69866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=O)N(C2=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)N=C1C

Isomeric SMILES

CC1=NC2=C(C(=O)N(C2=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)N=C1C

InChI

InChI=1S/C14H9ClN4O4/c1-6-7(2)17-12-11(16-6)13(20)18(14(12)21)10-5-8(19(22)23)3-4-9(10)15/h3-5H,1-2H3