2-[1-(ethoxyamino)propylidene]-5-[6-(4-methylsulfinylphenoxy)pyridin-2-yl]cyclohexane-1,3-dione

Systemtic Name: 2-[1-(ethoxyamino)propylidene]-5-[6-(4-methylsulfinylphenoxy)pyridin-2-yl]cyclohexane-1,3-dione Openeye Name: 2-[1-(ethoxyamino)propylidene]-5-[6-(4-methylsulfinylphenoxy)-2-pyridyl]cyclohexane-1,3-dione CAS Name: 2-[1-(ethoxyamino)propylidene]-5-[6-(4-methylsulfinylphenoxy)-2-pyridinyl]cyclohexane-1,3-dione IUPAC Name: 2-[1-(ethoxyamino)propylidene]-5-[6-(4-methylsulfinylphenoxy)pyridin-2-yl]cyclohexane-1,3-dione Traditional Name: 2-[1-(ethoxyamino)propylidene]-5-[6-(4-methylsulfinylphenoxy)-2-pyridyl]cyclohexane-1,3-quinone Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O5S/c1-4-18(25-29-5-2)23-20(26)13-15(14-21(23)27)19-7-6-8-22(24-19)30-16-9-11-17(12-10-16)31(3)28/h6-12,15,25H,4-5,13-14H2,1-3H3