methyl 4-(1-ethyl-6-oxidanylidene-pyridazin-3-yl)-3-methylsulfonyl-benzoate

Systemtic Name: methyl 4-(1-ethyl-6-oxidanylidene-pyridazin-3-yl)-3-methylsulfonyl-benzoate Openeye Name: methyl 4-(1-ethyl-6-oxo-pyridazin-3-yl)-3-methylsulfonyl-benzoate CAS Name: 4-(1-ethyl-6-oxo-3-pyridazinyl)-3-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-(1-ethyl-6-oxopyridazin-3-yl)-3-methylsulfonylbenzoate Traditional Name: 4-(1-ethyl-6-keto-pyridazin-3-yl)-3-mesyl-benzoic acid methyl ester Formula: C15H16N2O5S MolecularWeight: 336.36294

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C=CC(=N1)C2=C(C=C(C=C2)C(=O)OC)S(=O)(=O)C

Isomeric SMILES

CCN1C(=O)C=CC(=N1)C2=C(C=C(C=C2)C(=O)OC)S(=O)(=O)C

InChI

InChI=1S/C15H16N2O5S/c1-4-17-14(18)8-7-12(16-17)11-6-5-10(15(19)22-2)9-13(11)23(3,20)21/h5-9H,4H2,1-3H3