4-(4-tert-butylphenoxy)-N-(2-chloranyl-5-methylsulfonyl-phenyl)butanamide

Systemtic Name: 4-(4-tert-butylphenoxy)-N-(2-chloranyl-5-methylsulfonyl-phenyl)butanamide Openeye Name: 4-(4-tert-butylphenoxy)-N-(2-chloro-5-methylsulfonyl-phenyl)butanamide CAS Name: 4-(4-tert-butylphenoxy)-N-(2-chloro-5-methylsulfonylphenyl)butanamide IUPAC Name: 4-(4-tert-butylphenoxy)-N-(2-chloro-5-methylsulfonylphenyl)butanamide Traditional Name: 4-(4-tert-butylphenoxy)-N-(2-chloro-5-mesyl-phenyl)butyramide Formula: C21H26ClNO4S MolecularWeight: 423.95344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C21H26ClNO4S/c1-21(2,3)15-7-9-16(10-8-15)27-13-5-6-20(24)23-19-14-17(28(4,25)26)11-12-18(19)22/h7-12,14H,5-6,13H2,1-4H3,(H,23,24)