2-[(4-chloranyl-3-nitro-phenyl)methyl]-1H-pyridazine-3,6-dione

Systemtic Name: 2-[(4-chloranyl-3-nitro-phenyl)methyl]-1H-pyridazine-3,6-dione Openeye Name: 2-[(4-chloro-3-nitro-phenyl)methyl]-1H-pyridazine-3,6-dione CAS Name: 2-[(4-chloro-3-nitrophenyl)methyl]-1H-pyridazine-3,6-dione IUPAC Name: 2-[(4-chloro-3-nitrophenyl)methyl]-1H-pyridazine-3,6-dione Traditional Name: 2-(4-chloro-3-nitro-benzyl)-1H-pyridazine-3,6-quinone Formula: C11H8ClN3O4 MolecularWeight: 281.65192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CN2C(=O)C=CC(=O)N2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1CN2C(=O)C=CC(=O)N2)[N+](=O)[O-])Cl

InChI

InChI=1S/C11H8ClN3O4/c12-8-2-1-7(5-9(8)15(18)19)6-14-11(17)4-3-10(16)13-14/h1-5H,6H2,(H,13,16)