2-[(2E)-2-ethoxyimino-1-oxidanyl-propylidene]-5-[6-(4-methylsulfonylphenoxy)pyridin-2-yl]cyclohexane-1,3-dione

Systemtic Name: 2-[(2E)-2-ethoxyimino-1-oxidanyl-propylidene]-5-[6-(4-methylsulfonylphenoxy)pyridin-2-yl]cyclohexane-1,3-dione Openeye Name: 2-[(2E)-2-ethoxyimino-1-hydroxy-propylidene]-5-[6-(4-methylsulfonylphenoxy)-2-pyridyl]cyclohexane-1,3-dione CAS Name: 2-[(2E)-2-ethoxyimino-1-hydroxypropylidene]-5-[6-(4-methylsulfonylphenoxy)-2-pyridinyl]cyclohexane-1,3-dione IUPAC Name: 2-[(2E)-2-ethoxyimino-1-hydroxypropylidene]-5-[6-(4-methylsulfonylphenoxy)pyridin-2-yl]cyclohexane-1,3-dione Traditional Name: 2-[(2E)-2-ethyloximino-1-hydroxy-propylidene]-5-[6-(4-mesylphenoxy)-2-pyridyl]cyclohexane-1,3-quinone Formula: C23H24N2O7S MolecularWeight: 472.51086

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Descriptors Computed from Structure

Canonical SMILES:

CCON=C(C)C(=C1C(=O)CC(CC1=O)C2=NC(=CC=C2)OC3=CC=C(C=C3)S(=O)(=O)C)O

Isomeric SMILES

CCO/N=C(\C)/C(=C1C(=O)CC(CC1=O)C2=NC(=CC=C2)OC3=CC=C(C=C3)S(=O)(=O)C)O

InChI

InChI=1S/C23H24N2O7S/c1-4-31-25-14(2)23(28)22-19(26)12-15(13-20(22)27)18-6-5-7-21(24-18)32-16-8-10-17(11-9-16)33(3,29)30/h5-11,15,28H,4,12-13H2,1-3H3/b23-22?,25-14+