[4,5-bis(chloranyl)-6-oxidanylidene-pyridazin-1-yl]methyl 4-nitrobenzoate

Systemtic Name: [4,5-bis(chloranyl)-6-oxidanylidene-pyridazin-1-yl]methyl 4-nitrobenzoate Openeye Name: (4,5-dichloro-6-oxo-pyridazin-1-yl)methyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (4,5-dichloro-6-oxo-1-pyridazinyl)methyl ester IUPAC Name: (4,5-dichloro-6-oxopyridazin-1-yl)methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (4,5-dichloro-6-keto-pyridazin-1-yl)methyl ester Formula: C12H7Cl2N3O5 MolecularWeight: 344.10708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCN2C(=O)C(=C(C=N2)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCN2C(=O)C(=C(C=N2)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H7Cl2N3O5/c13-9-5-15-16(11(18)10(9)14)6-22-12(19)7-1-3-8(4-2-7)17(20)21/h1-5H,6H2