2-[(5-chloranyl-2-fluoranyl-phenyl)-(4-chlorophenyl)sulfonyl-amino]hexan-3-yl butanoate

Systemtic Name: 2-[(5-chloranyl-2-fluoranyl-phenyl)-(4-chlorophenyl)sulfonyl-amino]hexan-3-yl butanoate Openeye Name: 1-[1-(5-chloro-N-(4-chlorophenyl)sulfonyl-2-fluoro-anilino)ethyl]butyl butanoate CAS Name: butanoic acid 2-(5-chloro-N-(4-chlorophenyl)sulfonyl-2-fluoroanilino)hexan-3-yl ester IUPAC Name: 2-(5-chloro-N-(4-chlorophenyl)sulfonyl-2-fluoroanilino)hexan-3-yl butanoate Traditional Name: butyric acid 1-[1-(5-chloro-N-(4-chlorophenyl)sulfonyl-2-fluoro-anilino)ethyl]butyl ester Formula: C22H26Cl2FNO4S MolecularWeight: 490.415543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C)N(C1=C(C=CC(=C1)Cl)F)S(=O)(=O)C2=CC=C(C=C2)Cl)OC(=O)CCC

Isomeric SMILES

CCCC(C(C)N(C1=C(C=CC(=C1)Cl)F)S(=O)(=O)C2=CC=C(C=C2)Cl)OC(=O)CCC

InChI

InChI=1S/C22H26Cl2FNO4S/c1-4-6-21(30-22(27)7-5-2)15(3)26(20-14-17(24)10-13-19(20)25)31(28,29)18-11-8-16(23)9-12-18/h8-15,21H,4-7H2,1-3H3