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

Systemtic Name: [4,5-bis(chloranyl)-6-oxidanylidene-pyridazin-1-yl]methyl 4-methylbenzoate Openeye Name: (4,5-dichloro-6-oxo-pyridazin-1-yl)methyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid (4,5-dichloro-6-oxo-1-pyridazinyl)methyl ester IUPAC Name: (4,5-dichloro-6-oxopyridazin-1-yl)methyl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid (4,5-dichloro-6-keto-pyridazin-1-yl)methyl ester Formula: C13H10Cl2N2O3 MolecularWeight: 313.1361

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCN2C(=O)C(=C(C=N2)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCN2C(=O)C(=C(C=N2)Cl)Cl

InChI

InChI=1S/C13H10Cl2N2O3/c1-8-2-4-9(5-3-8)13(19)20-7-17-12(18)11(15)10(14)6-16-17/h2-6H,7H2,1H3