[4,5-bis(chloranyl)-6-oxidanylidene-pyridazin-1-yl]methyl 3-tert-butylbenzoate

Systemtic Name: [4,5-bis(chloranyl)-6-oxidanylidene-pyridazin-1-yl]methyl 3-tert-butylbenzoate Openeye Name: (4,5-dichloro-6-oxo-pyridazin-1-yl)methyl 3-tert-butylbenzoate CAS Name: 3-tert-butylbenzoic acid (4,5-dichloro-6-oxo-1-pyridazinyl)methyl ester IUPAC Name: (4,5-dichloro-6-oxopyridazin-1-yl)methyl 3-tert-butylbenzoate Traditional Name: 3-tert-butylbenzoic acid (4,5-dichloro-6-keto-pyridazin-1-yl)methyl ester Formula: C16H16Cl2N2O3 MolecularWeight: 355.21584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16Cl2N2O3/c1-16(2,3)11-6-4-5-10(7-11)15(22)23-9-20-14(21)13(18)12(17)8-19-20/h4-8H,9H2,1-3H3