methyl 2-chloranyl-5-methylsulfonyl-4-(1H-pyridazin-2-yl)benzoate

Systemtic Name: methyl 2-chloranyl-5-methylsulfonyl-4-(1H-pyridazin-2-yl)benzoate Openeye Name: methyl 2-chloro-5-methylsulfonyl-4-(1H-pyridazin-2-yl)benzoate CAS Name: 2-chloro-5-methylsulfonyl-4-(1H-pyridazin-2-yl)benzoic acid methyl ester IUPAC Name: methyl 2-chloro-5-methylsulfonyl-4-(1H-pyridazin-2-yl)benzoate Traditional Name: 2-chloro-5-mesyl-4-(1H-pyridazin-2-yl)benzoic acid methyl ester Formula: C13H13ClN2O4S MolecularWeight: 328.77132

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1Cl)N2C=CC=CN2)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1Cl)N2C=CC=CN2)S(=O)(=O)C

InChI

InChI=1S/C13H13ClN2O4S/c1-20-13(17)9-7-12(21(2,18)19)11(8-10(9)14)16-6-4-3-5-15-16/h3-8,15H,1-2H3