methyl 2-methyl-3-methylsulfonyl-4-(4-oxidanylidenepyridin-1-yl)benzoate

Systemtic Name: methyl 2-methyl-3-methylsulfonyl-4-(4-oxidanylidenepyridin-1-yl)benzoate Openeye Name: methyl 2-methyl-3-methylsulfonyl-4-(4-oxo-1-pyridyl)benzoate CAS Name: 2-methyl-3-methylsulfonyl-4-(4-oxo-1-pyridinyl)benzoic acid methyl ester IUPAC Name: methyl 2-methyl-3-methylsulfonyl-4-(4-oxopyridin-1-yl)benzoate Traditional Name: 4-(4-keto-1-pyridyl)-3-mesyl-2-methyl-benzoic acid methyl ester Formula: C15H15NO5S MolecularWeight: 321.3483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1S(=O)(=O)C)N2C=CC(=O)C=C2)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=C1S(=O)(=O)C)N2C=CC(=O)C=C2)C(=O)OC

InChI

InChI=1S/C15H15NO5S/c1-10-12(15(18)21-2)4-5-13(14(10)22(3,19)20)16-8-6-11(17)7-9-16/h4-9H,1-3H3