methyl 5-methylsulfonyl-4-(4-oxidanylidenepyridin-1-yl)-2-propyl-benzoate

Systemtic Name: methyl 5-methylsulfonyl-4-(4-oxidanylidenepyridin-1-yl)-2-propyl-benzoate Openeye Name: methyl 5-methylsulfonyl-4-(4-oxo-1-pyridyl)-2-propyl-benzoate CAS Name: 5-methylsulfonyl-4-(4-oxo-1-pyridinyl)-2-propylbenzoic acid methyl ester IUPAC Name: methyl 5-methylsulfonyl-4-(4-oxopyridin-1-yl)-2-propylbenzoate Traditional Name: 4-(4-keto-1-pyridyl)-5-mesyl-2-propyl-benzoic acid methyl ester Formula: C17H19NO5S MolecularWeight: 349.40146

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)C)N2C=CC(=O)C=C2

Isomeric SMILES

CCCC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)C)N2C=CC(=O)C=C2

InChI

InChI=1S/C17H19NO5S/c1-4-5-12-10-15(18-8-6-13(19)7-9-18)16(24(3,21)22)11-14(12)17(20)23-2/h6-11H,4-5H2,1-3H3