N-(5-ethylsulfonyl-2-oxidanyl-phenyl)-4-oxidanylidene-4-(4-propoxyphenyl)butanamide

Systemtic Name: N-(5-ethylsulfonyl-2-oxidanyl-phenyl)-4-oxidanylidene-4-(4-propoxyphenyl)butanamide Openeye Name: N-(5-ethylsulfonyl-2-hydroxy-phenyl)-4-oxo-4-(4-propoxyphenyl)butanamide CAS Name: N-(5-ethylsulfonyl-2-hydroxyphenyl)-4-oxo-4-(4-propoxyphenyl)butanamide IUPAC Name: N-(5-ethylsulfonyl-2-hydroxyphenyl)-4-oxo-4-(4-propoxyphenyl)butanamide Traditional Name: N-(5-esyl-2-hydroxy-phenyl)-4-keto-4-(4-propoxyphenyl)butyramide Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)CCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)CC)O

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)CCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)CC)O

InChI

InChI=1S/C21H25NO6S/c1-3-13-28-16-7-5-15(6-8-16)19(23)11-12-21(25)22-18-14-17(9-10-20(18)24)29(26,27)4-2/h5-10,14,24H,3-4,11-13H2,1-2H3,(H,22,25)