N-[3-(4-decoxyphenyl)sulfonylphenyl]-4,4-dimethyl-2-oxidanyl-3-oxidanylidene-pentanamide

Systemtic Name: N-[3-(4-decoxyphenyl)sulfonylphenyl]-4,4-dimethyl-2-oxidanyl-3-oxidanylidene-pentanamide Openeye Name: N-[3-(4-decoxyphenyl)sulfonylphenyl]-2-hydroxy-4,4-dimethyl-3-oxo-pentanamide CAS Name: N-[3-(4-decoxyphenyl)sulfonylphenyl]-2-hydroxy-4,4-dimethyl-3-oxopentanamide IUPAC Name: N-[3-(4-decoxyphenyl)sulfonylphenyl]-2-hydroxy-4,4-dimethyl-3-oxopentanamide Traditional Name: N-[3-(4-decoxyphenyl)sulfonylphenyl]-2-hydroxy-3-keto-4,4-dimethyl-valeramide Formula: C29H41NO6S MolecularWeight: 531.70394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C(C(=O)C(C)(C)C)O

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)C(C(=O)C(C)(C)C)O

InChI

InChI=1S/C29H41NO6S/c1-5-6-7-8-9-10-11-12-20-36-23-16-18-24(19-17-23)37(34,35)25-15-13-14-22(21-25)30-28(33)26(31)27(32)29(2,3)4/h13-19,21,26,31H,5-12,20H2,1-4H3,(H,30,33)