2-[4-chloranyl-2-(3-ethynylphenyl)carbonyl-phenoxy]-N-(2-methyl-4-methylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[4-chloranyl-2-(3-ethynylphenyl)carbonyl-phenoxy]-N-(2-methyl-4-methylsulfonyl-phenyl)ethanamide Openeye Name: 2-[4-chloro-2-(3-ethynylbenzoyl)phenoxy]-N-(2-methyl-4-methylsulfonyl-phenyl)acetamide CAS Name: 2-[4-chloro-2-[(3-ethynylphenyl)-oxomethyl]phenoxy]-N-(2-methyl-4-methylsulfonylphenyl)acetamide IUPAC Name: 2-[4-chloro-2-(3-ethynylbenzoyl)phenoxy]-N-(2-methyl-4-methylsulfonylphenyl)acetamide Traditional Name: 2-[4-chloro-2-(3-ethynylbenzoyl)phenoxy]-N-(4-mesyl-2-methyl-phenyl)acetamide Formula: C25H20ClNO5S MolecularWeight: 481.948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)C)NC(=O)COC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC(=C3)C#C

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)C)NC(=O)COC2=C(C=C(C=C2)Cl)C(=O)C3=CC=CC(=C3)C#C

InChI

InChI=1S/C25H20ClNO5S/c1-4-17-6-5-7-18(13-17)25(29)21-14-19(26)8-11-23(21)32-15-24(28)27-22-10-9-20(12-16(22)2)33(3,30)31/h1,5-14H,15H2,2-3H3,(H,27,28)